Version2.0
2020-08-07T19:52:51Z
10.1021/jm300687e
Gaussian16
RevisionB.01
SBUNGAY
23-Jul-2020
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE c1ccc2c(c1)CCC[C@]23C(=O)N(C(=O)N3)CC(=O)Nc4ccccc4C#N C03600646
RHF
6-31G(d)
(6D,7F)
c1ccc2c(c1)CCC[C@]23C(=O)N(C(=O)N3)CC(=O)Nc4ccccc4C#N
C01[X(C21H18N4O3)]
132
C1
456
N#Cc1ccccc1NC(=O)CN1C(=O)N[C@]2(C1=O)CCCc1c2cccc1
N#Cc1ccccc1NC(=O)CN1C(=O)N[C@]2(C1=O)CCCc1c2cccc1
O=C(CN1C(=O)N[C@@]2(CCCc3ccccc23)C1=O)Nc4ccccc4C#N
InChIKey=NBUWHCPJPQKDGQ-OAQYLSRUSA-N
InChI=1S/C21H18N4O3/c22-12-15-7-2-4-10-17(15)23-18(26)13-25-19(27)21(24-20(25)28)11-5-8-14-6-1-3-9-16(14)21/h1-4,6-7,9-10H,5,8,11,13H2,(H,23,26)(H,24,28)/t21-/m1/s1
InChI=1/C21H18N4O3/c22-12-15-7-2-4-10-17(15)23-18(26)13-25-19(27)21(24-20(25)28)11-5-8-14-6-1-3-9-16(14)21/h1-4,6-7,9-10H,5,8,11,13H2,(H,23,26)(H,24,28)/t21-/m1/s1/f/h23-24H
c1ccc2c(c1)CCC[C@]23C(=O)N(C(=O)N3)CC(=O)Nc4ccccc4C#N
C01[X(C21H18N4O3)]
132
C01
456
N#Cc1ccccc1NC(=O)CN1C(=O)N[C@]2(C1=O)CCCc1c2cccc1
N#C[C]1[CH][CH][CH][CH][C]1NC(=O)CN1C(=O)N[C@]2(C1=O)CCC[C]1[C]2[CH][CH][CH][CH]1
O=C(CN1C(=O)N[C@@]2(CCC[C]3[CH][CH][CH][CH][C]23)C1=O)N[C]4[CH][CH][CH][CH][C]4C#N
InChIKey=NBUWHCPJPQKDGQ-OAQYLSRUSA-N
InChI=1S/C21H18N4O3/c22-12-15-7-2-4-10-17(15)23-18(26)13-25-19(27)21(24-20(25)28)11-5-8-14-6-1-3-9-16(14)21/h1-4,6-7,9-10H,5,8,11,13H2,(H,23,26)(H,24,28)/t21-/m1/s1
InChI=1/C21H18N4O3/c22-12-15-7-2-4-10-17(15)23-18(26)13-25-19(27)21(24-20(25)28)11-5-8-14-6-1-3-9-16(14)21/h1-4,6-7,9-10H,5,8,11,13H2,(H,23,26)(H,24,28)/t21-/m1/s1/f/h23-24H
2460.1277942438
-1248.1981052
1-A
14353.7778
98
358
456
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0.08552 0.11915 0.12521 0.13385 0.16730 0.19699 0.20250 0.21644 0.21846 0.23081 0.23649 0.24540 0.24967 0.26104 0.26424 0.27916 0.28645 0.29088 0.30183 0.30494 0.30664 0.31180 0.31893 0.32129 0.32651 0.33302 0.34204 0.35965 0.36088 0.37261 0.38670 0.39126 0.39274 0.40354 0.41359 0.41598 0.42290 0.44514 0.44981 0.45750 0.46413 0.47495 0.48547 0.48988 0.49601 0.50207 0.50773 0.51746 0.52713 0.53348 0.53765 0.57083 0.58468 0.58730 0.61569 0.66758 0.67139 0.69485 0.69849 0.70574 0.70910 0.71708 0.72586 0.72670 0.73880 0.74570 0.75018 0.75433 0.75675 0.76189 0.76908 0.77146 0.78040 0.78427 0.79253 0.79831 0.80437 0.80617 0.81061 0.81836 0.82107 0.82823 0.83246 0.84171 0.84712 0.84763 0.85537 0.86351 0.87151 0.87786 0.88691 0.88933 0.89428 0.90172 0.92375 0.92974 0.93757 0.94604 0.95026 0.96437 0.97320 0.97750 0.98753 0.99828 1.00975 1.01394 1.02293 1.03294 1.03988 1.04710 1.05455 1.05933 1.06715 1.07275 1.07923 1.08577 1.09326 1.09997 1.10033 1.10414 1.10990 1.11370 1.11808 1.12390 1.13453 1.14073 1.15247 1.15776 1.16135 1.16634 1.17070 1.18087 1.18348 1.18576 1.19494 1.20062 1.21047 1.22005 1.22903 1.23444 1.23937 1.25001 1.25730 1.27740 1.28042 1.29164 1.30270 1.30519 1.31311 1.32676 1.34016 1.35381 1.35635 1.36540 1.38102 1.38601 1.39763 1.40810 1.42368 1.43460 1.44467 1.44715 1.45092 1.46570 1.47420 1.48489 1.50126 1.50791 1.51869 1.53093 1.55621 1.56741 1.58114 1.60766 1.60881 1.62213 1.63745 1.64651 1.65577 1.67089 1.68887 1.69973 1.70149 1.71203 1.71267 1.71964 1.74101 1.74949 1.75792 1.76666 1.77132 1.77255 1.78374 1.81108 1.81913 1.82579 1.83996 1.85523 1.87869 1.88269 1.92424 1.93253 1.95174 1.95623 1.97337 2.01400 2.02297 2.03203 2.03453 2.05237 2.05959 2.06239 2.06517 2.07396 2.08143 2.09615 2.09976 2.10258 2.12566 2.13786 2.14350 2.15111 2.16110 2.16916 2.17749 2.18425 2.19150 2.19350 2.20518 2.22155 2.23368 2.23680 2.25204 2.25760 2.26308 2.27075 2.27691 2.29494 2.29783 2.30533 2.31710 2.32238 2.33518 2.33974 2.34685 2.36023 2.36755 2.38490 2.39119 2.41362 2.41659 2.43218 2.43698 2.44662 2.46196 2.46773 2.47987 2.49748 2.50146 2.51165 2.52092 2.54465 2.55224 2.57136 2.57988 2.58547 2.59161 2.60198 2.61751 2.62863 2.63316 2.64405 2.65145 2.66966 2.67963 2.69914 2.71671 2.72909 2.74516 2.75275 2.76204 2.79955 2.80612 2.83839 2.84042 2.85799 2.87657 2.91050 2.91084 2.92411 2.94441 2.96252 2.97919 2.98224 2.99949 3.00954 3.01804 3.02697 3.04006 3.04323 3.04860 3.07022 3.08297 3.09939 3.11679 3.12624 3.13296 3.15980 3.16877 3.17179 3.19282 3.20880 3.21177 3.22165 3.24635 3.29161 3.32815 3.34205 3.36001 3.40480 3.42197 3.42866 3.49892 3.54422 3.62328 3.66676 3.70196 3.74037 3.82350 3.88351 4.43922 4.45268 4.50645 4.51187 4.52561 4.53544 4.54644 4.56168 4.57260 4.59382 4.59560 4.64210 4.65428 4.72189 4.73991 4.75767 4.78644 4.80208 4.83878 4.90816 4.95293 4.96264 4.98309 5.05170 5.12169 5.25371 5.25792 5.43235
11.33780
2.0188 -3.1516 -0.2958
3.7544
|XX|YY|ZZ|XY|XZ|YZ|
-123.9833 -159.3864 -179.6868 15.9911 2.9232 0.4333
|XX|YY|ZZ|XY|XZ|YZ|
30.3689 -5.0342 -25.3347 15.9911 2.9232 0.4333
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
-10.8506 -58.3183 -4.5656 77.3366 -136.8115 -12.9845 10.0080 -16.7868 5.0698 -12.7008
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
-14624.8750 -2272.8535 -977.1421 826.1053 -24.7522 420.2071 36.4648 41.7287 -25.6974 -3258.5518 -3087.0654 -537.1620 49.7668 -60.7468 -49.6675
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1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
11.4612 15.2466 21.3164 50.7694 56.1683 64.3394 75.1553 86.0690 98.5125 133.4359 149.1324 176.6668 187.8185 199.6232 248.3902 268.8911 277.8575 292.7917 306.8536 332.5264 353.8704 375.2664 383.0304 418.9481 432.4369 437.0922 456.2521 492.7476 515.6945 530.0289 542.5645 553.0899 591.4474 595.1522 624.0139 634.3550 641.3311 642.9032 661.9059 687.4722 710.8580 755.4866 773.2593 793.9658 818.5843 826.4960 827.0861 829.7340 852.8971 864.3881 866.6972 880.4202 906.5543 932.9761 953.0503 988.8156 995.3247 1004.6469 1012.5078 1047.0049 1063.0846 1081.7309 1092.4081 1105.5112 1120.7724 1123.2502 1138.1442 1142.1894 1146.7709 1176.7248 1202.3449 1206.1268 1229.4125 1231.4379 1242.6992 1249.1348 1293.0478 1294.9022 1298.1758 1306.6386 1308.7913 1325.7766 1334.6798 1341.7365 1373.6723 1385.2598 1400.2406 1427.7877 1432.6264 1440.7522 1502.2488 1509.0859 1521.8624 1528.4293 1552.8759 1567.3222 1597.5094 1610.4220 1618.2494 1620.2791 1627.7796 1638.3725 1643.0518 1651.5558 1669.6571 1731.2396 1778.6117 1792.5644 1812.8684 1813.0934 1989.7599 1994.0299 2049.3518 2588.0212 3192.4168 3200.1469 3230.9818 3241.5208 3253.1741 3267.1319 3282.7083 3322.1487 3351.6126 3359.4821 3373.4902 3374.5948 3387.8250 3389.4549 3403.0661 3473.4232 3842.9354 3904.1005
6.9202 6.2718 5.8969 5.3332 5.1452 4.7792 7.2473 7.6511 9.9800 5.6380 5.4846 4.0216 7.8103 3.8020 5.3310 5.0860 3.5043 2.9216 3.8738 4.3654 3.6446 3.3566 2.3631 2.7686 3.0145 4.0997 6.6236 2.8679 6.1043 4.3507 3.6113 2.9759 2.1576 3.3633 6.7344 2.2209 2.8062 2.5125 8.1174 8.7644 5.5729 3.8048 6.0579 6.1025 3.7041 4.5980 2.7440 5.9735 4.3279 1.2554 2.1908 4.4014 4.5189 3.4630 1.4706 1.7852 1.9119 1.3880 2.9057 6.0823 3.1904 1.4306 1.3536 2.4876 1.9583 1.3583 1.3345 2.5223 2.3620 2.7059 2.8363 2.6969 2.7045 2.3035 1.9250 2.1180 1.7458 2.3763 2.1640 2.2377 2.0262 1.8725 1.7284 1.9226 1.6765 2.0464 2.2848 1.5238 1.4728 1.8188 1.7557 1.4511 1.5419 1.5644 1.5428 1.9854 1.5523 2.4822 2.1527 2.5072 1.1328 1.0875 2.3010 1.1086 2.3258 2.4979 6.3538 3.6093 5.1642 3.6779 10.4979 9.5356 11.3484 12.7014 1.0706 1.0670 1.0656 1.0948 1.0956 1.0606 1.1059 1.1068 1.0881 1.0898 1.0943 1.0892 1.0928 1.0986 1.0985 1.0936 1.0784 1.0802
0.0005 0.0009 0.0016 0.0081 0.0096 0.0117 0.0241 0.0334 0.0571 0.0591 0.0719 0.0740 0.1623 0.0893 0.1938 0.2167 0.1594 0.1476 0.2149 0.2844 0.2689 0.2785 0.2043 0.2863 0.3321 0.4615 0.8124 0.4103 0.9565 0.7201 0.6264 0.5364 0.4447 0.7019 1.5450 0.5266 0.6800 0.6118 2.0954 2.4405 1.6592 1.2795 2.1341 2.2665 1.4624 1.8506 1.1060 2.4230 1.8549 0.5527 0.9696 2.0101 2.1881 1.7760 0.7870 1.0284 1.1160 0.8254 1.7551 3.9284 2.1244 0.9863 0.9517 1.7913 1.4493 1.0097 1.0185 1.9388 1.8301 2.2076 2.4158 2.3115 2.4084 2.0581 1.7516 1.9471 1.7198 2.3476 2.1487 2.2510 2.0449 1.9391 1.8140 2.0392 1.8639 2.3136 2.6394 1.8303 1.7810 2.2244 2.3345 1.9470 2.1041 2.1532 2.1919 2.8736 2.3340 3.7929 3.3214 3.8780 1.7684 1.7198 3.6599 1.7817 3.8202 4.4110 11.8425 6.8332 9.9997 7.1235 24.4880 22.3389 28.0813 50.1229 6.4283 6.4381 6.5544 6.7775 6.8312 6.6700 7.0218 7.1973 7.2012 7.2467 7.3373 7.3082 7.3896 7.4361 7.4951 7.7738 9.3837 9.7006
0.0420 1.6384 1.1105 0.7175 1.3435 0.1278 2.6119 3.4310 7.2458 1.4630 2.3705 2.8507 1.8730 2.5877 15.1497 0.6338 6.6225 9.8168 8.8851 4.6736 13.9412 4.8431 30.5836 65.7473 21.1320 0.2423 55.9332 6.8517 7.0202 2.1024 4.7122 30.5963 26.8033 4.4624 4.9567 5.1499 33.7908 1.8825 4.9859 19.3559 15.1098 0.0496 11.5898 10.9922 3.2688 11.2845 31.3821 1.9238 2.1308 73.5632 37.2339 44.9337 5.2171 4.3324 4.6018 0.5462 1.5825 2.7005 5.2467 4.9353 52.9043 4.2528 2.6616 0.8829 1.1414 0.0301 2.0212 5.2532 4.2175 3.7618 2.1148 21.7694 48.0197 0.2060 12.0177 5.8875 3.5622 23.9184 13.1063 71.0228 123.1511 6.7768 29.2962 0.7521 18.8930 241.5578 34.9900 7.5794 14.8663 176.5255 49.2299 12.4982 2.6793 19.1536 36.6360 23.3859 163.8454 654.2387 5.7156 9.7488 6.8577 10.8735 26.2535 0.9443 19.0067 304.5193 1.4807 296.3974 8.3948 72.8182 652.7343 690.3616 116.6027 64.7531 20.4547 34.1018 6.5544 45.9256 59.5438 17.2338 23.6320 0.1449 10.9557 3.3528 34.2209 3.8164 10.7697 27.6283 15.3578 5.3340 50.5181 75.8902
1.5774 2.5493 0.0456 2.4884 6.6039 3.2896 1.7355 1.7676 1.1297 2.3307 1.3057 1.6082 3.0544 0.7036 2.5142 2.1693 0.3735 0.6613 0.8412 1.7990 0.4465 1.4124 1.9202 1.0305 1.7653 3.3839 1.3128 2.8418 7.0804 1.7634 1.8851 0.8909 4.5872 0.7381 10.5508 0.7016 1.8470 1.8373 1.3991 8.0322 7.8996 2.4430 2.2776 6.8788 9.4646 1.8618 6.1270 0.3528 2.4611 0.4781 0.7873 1.0488 4.9948 2.6598 0.5757 4.1858 1.4374 3.1428 6.5489 8.6881 0.6711 0.7258 0.7111 4.3175 7.5421 0.4609 0.3061 22.7680 27.3256 2.0503 7.5274 6.5772 32.6639 5.4766 1.9313 1.6152 1.8582 3.4816 11.0975 4.0509 10.3760 11.8127 12.5259 3.3229 5.4551 36.6078 1.1861 4.7242 8.9424 11.3419 9.5706 2.6021 5.4702 1.6128 1.9782 1.8082 7.2047 6.8288 0.9969 0.5672 18.9581 12.6162 22.8446 4.2154 1.7921 7.0493 10.9790 41.6440 46.6499 41.3340 10.5772 7.8829 13.8061 226.7123 122.3819 47.4417 60.4756 112.6579 137.4394 59.5099 64.2253 31.9625 43.1447 101.0865 68.7438 63.3070 86.0781 244.6912 211.3266 55.3539 46.8754 57.7666
0.7469 0.7498 0.7369 0.7465 0.7483 0.7499 0.7225 0.7500 0.6407 0.7490 0.7500 0.7262 0.7103 0.5976 0.2013 0.7430 0.7335 0.6590 0.4842 0.7340 0.4928 0.2269 0.5161 0.5551 0.3580 0.7500 0.5844 0.2785 0.3116 0.1142 0.2879 0.6416 0.7287 0.5036 0.6377 0.4559 0.7083 0.5031 0.1594 0.1172 0.2951 0.2343 0.4912 0.2276 0.1327 0.7432 0.1917 0.6572 0.2035 0.7442 0.5404 0.2136 0.3274 0.5019 0.3717 0.7288 0.6608 0.7277 0.1309 0.1738 0.7290 0.6376 0.7499 0.3219 0.5583 0.2981 0.7451 0.0943 0.1216 0.7433 0.6647 0.5107 0.6781 0.4495 0.4845 0.7192 0.6306 0.7249 0.2212 0.2011 0.1337 0.3677 0.1735 0.3706 0.7270 0.1422 0.7110 0.6012 0.7239 0.1964 0.6798 0.5889 0.3713 0.2388 0.5670 0.7308 0.5403 0.7500 0.6990 0.5615 0.6950 0.7462 0.2188 0.5272 0.7482 0.5202 0.4976 0.4852 0.7385 0.7256 0.4112 0.3037 0.2842 0.2662 0.1575 0.3147 0.3784 0.3285 0.2952 0.0301 0.5859 0.7303 0.5644 0.5405 0.6284 0.5826 0.6927 0.1272 0.1473 0.2118 0.1241 0.2511
0.8551 0.8570 0.8485 0.8548 0.8560 0.8571 0.8389 0.8571 0.7810 0.8565 0.8571 0.8414 0.8306 0.7481 0.3351 0.8525 0.8463 0.7944 0.6525 0.8466 0.6602 0.3698 0.6808 0.7139 0.5273 0.8571 0.7377 0.4357 0.4751 0.2049 0.4471 0.7817 0.8430 0.6699 0.7788 0.6263 0.8292 0.6694 0.2750 0.2098 0.4557 0.3797 0.6588 0.3707 0.2344 0.8527 0.3218 0.7932 0.3382 0.8533 0.7016 0.3520 0.4933 0.6683 0.5420 0.8431 0.7958 0.8424 0.2315 0.2962 0.8432 0.7787 0.8570 0.4870 0.7166 0.4592 0.8539 0.1723 0.2168 0.8528 0.7986 0.6762 0.8082 0.6202 0.6527 0.8367 0.7735 0.8405 0.3622 0.3348 0.2359 0.5377 0.2957 0.5408 0.8419 0.2490 0.8311 0.7509 0.8398 0.3283 0.8094 0.7412 0.5415 0.3855 0.7237 0.8445 0.7015 0.8571 0.8228 0.7191 0.8200 0.8546 0.3591 0.6904 0.8560 0.6844 0.6646 0.6534 0.8496 0.8410 0.5828 0.4659 0.4426 0.4205 0.2721 0.4787 0.5491 0.4946 0.4559 0.0584 0.7389 0.8441 0.7215 0.7017 0.7718 0.7362 0.8184 0.2256 0.2568 0.3496 0.2209 0.4014
298.150
1.00000
1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46
6 6 6 6 6 6 6 6 6 6 6 8 7 6 8 7 6 6 8 7 6 6 6 6 6 6 6 7 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 15.99491 14.00307 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783
3774.3596 23476.8842 25126.8249
1.00000 0.00107 -0.00121 -0.00106 0.99999 0.00331 0.00121 -0.00331 0.99999
1
0.02295 0.00369 0.00345
0.47816 0.07687 0.07183
16.49 21.94 30.67 73.05 80.81 92.57 108.13 123.83 141.74 191.98 214.57 254.18 270.23 287.21 357.38 386.87 399.77 421.26 441.49 478.43 509.14 539.92 551.10 602.77 622.18 628.88 656.44 708.95 741.97 762.59 780.63 795.77 850.96 856.29 897.82 912.70 922.73 924.99 952.33 989.12 1022.77 1086.98 1112.55 1142.34 1177.76 1189.14 1189.99 1193.80 1227.13 1243.66 1246.98 1266.73 1304.33 1342.34 1371.23 1422.69 1432.05 1445.46 1456.77 1506.41 1529.54 1556.37 1571.73 1590.58 1612.54 1616.11 1637.54 1643.36 1649.95 1693.04 1729.91 1735.35 1768.85 1771.76 1787.97 1797.23 1860.41 1863.08 1867.79 1879.96 1883.06 1907.50 1920.31 1930.46 1976.41 1993.08 2014.63 2054.27 2061.23 2072.92 2161.40 2171.24 2189.62 2199.07 2234.24 2255.03 2298.46 2317.04 2328.30 2331.22 2342.01 2357.25 2363.99 2376.22 2402.26 2490.87 2559.03 2579.10 2608.31 2608.64 2862.82 2868.96 2948.56 3723.59 4593.18 4604.30 4648.66 4663.83 4680.59 4700.67 4723.09 4779.83 4822.22 4833.55 4853.70 4855.29 4874.32 4876.67 4896.25 4997.48 5529.13 5617.13
0.389652
0.411651
0.412595
0.334404
-1247.808453
-1247.786454
-1247.785510
-1247.863701
2.622539D-04
MUNgauss
RevisionA2.0
retrievium
07-Aug-2020
DUDE c1ccc2c(c1)CCC[C@]23C(=O)N(C(=O)N3)CC(=O)Nc4ccccc4C#N C03600646
RHF
6-31G(d)
(6D,10F)
C1
374.137891
|X|Y|Z|
109.662163 40.446367 26.307050
48.865553
23
|36.858105|
|13.713991|36.858105|
|7.976317|13.833700|36.858105|
|6.841700|7.881313|13.647249|36.858105|
|7.873268|6.817321|7.917401|13.694823|36.858105|
|13.828713|7.963803|6.934474|7.944401|13.648471|36.858105|
|5.023323|4.419305|4.989804|7.476900|12.557641|7.589687|36.858105|
|3.862773|3.717039|4.457697|6.590524|7.524439|5.011092|12.490847|36.858105|
|3.714133|3.842690|4.968784|7.474534|6.635126|4.470152|7.653975|12.505848|36.858105|
|4.417141|5.007479|7.547128|12.457534|7.480137|4.991863|6.355186|7.549729|12.396113|36.858105|
|3.732994|4.418178|6.387259|7.471798|5.092681|3.915836|4.436703|4.956684|7.679669|12.421177|36.858105|
|3.534409|4.090278|5.461536|6.076115|4.586676|3.682335|4.084145|4.330598|6.338087|7.801501|16.033947|73.516695|
|3.229551|3.872740|5.333303|5.566372|4.030248|3.279188|3.574450|4.062219|5.611556|8.146170|13.913198|14.874406|53.358707|
|3.239651|3.826882|5.194482|5.556785|4.102868|3.323725|3.674720|4.323764|5.558060|8.080521|8.304605|9.863855|18.605621|36.858105|
|2.818695|3.286079|4.161896|4.242138|3.355482|2.844868|3.064298|3.546582|4.226156|5.418449|5.553839|7.497758|11.307540|15.978713|73.516695|
|3.807961|4.374249|6.167906|7.717275|5.464087|4.103797|4.856182|5.995351|7.676940|13.057315|8.306480|9.796195|11.802187|14.110904|14.763033|53.358707|
|2.675530|3.153859|4.000711|3.992244|3.130703|2.672382|2.854925|3.180687|4.143952|5.123588|7.718874|11.800121|18.124774|7.688834|11.820880|7.288044|36.858105|
|2.312324|2.614422|3.200750|3.359334|2.779341|2.368378|2.668297|3.065944|3.986107|4.369074|5.926227|9.756077|10.630236|5.880227|9.620249|6.158846|12.465767|36.858105|
|2.317652|2.565396|3.145021|3.460254|2.913263|2.433142|2.894517|3.468020|4.627301|4.703793|5.959132|9.572221|9.621285|5.879528|9.309015|6.597195|7.980982|15.965780|73.516695|
|2.022895|2.269255|2.681797|2.744327|2.336930|2.047985|2.249606|2.520508|3.119129|3.348036|4.284332|7.499729|7.105142|4.271364|7.462668|4.689383|7.910422|13.956292|14.894228|53.358707|
|1.784417|1.962087|2.268147|2.345409|2.057408|1.819875|2.023090|2.268433|2.731030|2.806100|3.391988|6.035111|5.271877|3.381244|5.991780|3.907303|5.045437|7.644729|11.551205|18.525905|36.858105|
|1.726451|1.868462|2.153364|2.279698|2.034457|1.787810|2.049252|2.338759|2.796041|2.752862|3.207355|5.672314|4.811059|3.195809|5.614162|3.821377|4.214603|6.300719|11.712766|10.541120|13.683950|36.858105|
|1.539274|1.647703|1.865149|1.966687|1.789162|1.593330|1.815979|2.048697|2.376085|2.312652|2.614433|4.663384|3.829437|2.606395|4.621103|3.198202|3.236766|4.327763|8.005347|6.996046|7.936635|13.775662|36.858105|
|1.429365|1.532325|1.714931|1.779727|1.623395|1.464980|1.631294|1.807314|2.069565|2.048150|2.315661|4.163008|3.395727|2.309749|4.134395|2.830650|2.899073|3.663641|6.407420|6.167344|6.788816|7.868427|13.732788|36.858105|
|1.460732|1.581432|1.769776|1.809249|1.634077|1.481596|1.617380|1.773761|2.042077|2.068535|2.380513|4.296921|3.543406|2.375104|4.275114|2.863273|3.128026|3.877484|6.379974|7.030289|7.836417|6.850768|8.005494|13.829114|36.858105|
|1.618621|1.774884|2.012008|2.045133|1.815093|1.634597|1.775646|1.951901|2.290836|2.367056|2.805493|5.054168|4.285395|2.798801|5.031369|3.286749|3.997122|5.131575|7.858649|10.795027|13.588803|7.937494|6.938702|7.936748|13.692901|36.858105|
|1.626364|1.801299|2.027830|2.015153|1.777950|1.618991|1.710097|1.848790|2.157297|2.286379|2.730580|4.939793|4.207712|2.725907|4.933603|3.175609|4.004774|4.621898|6.762510|9.348653|7.749025|5.118695|4.549957|5.132840|7.791353|13.216019|36.858105|
|1.622036|1.807494|2.017628|1.970948|1.736393|1.596922|1.651343|1.762760|2.041489|2.196490|2.617864|4.744143|4.031139|2.614855|4.749546|3.049234|3.808656|4.054337|5.918916|7.516601|5.483602|3.968556|3.578279|3.959427|5.449631|7.388374|16.746299|53.358707|
|17.716202|8.890942|5.660396|4.935675|5.618544|8.942144|4.105384|3.238898|3.086936|3.535640|3.100257|5.312516|3.746667|2.761860|4.382181|4.291736|2.350523|2.055915|3.649411|2.488910|1.629251|1.576644|1.418870|1.326712|1.356678|1.493367|1.506410|2.053809|0.500000|
|8.882357|17.722951|8.943482|5.621627|4.923492|5.653714|3.537278|3.088670|3.221142|4.093290|3.852072|6.458324|4.815880|3.472243|5.479213|5.115919|2.999608|2.469945|4.234934|2.973481|1.890411|1.782561|1.579510|1.483028|1.542076|1.730939|1.778821|2.455652|0.213711|0.500000|
|5.670254|8.989712|17.706359|8.888089|5.635322|4.983017|4.064018|3.894629|4.550547|7.041612|7.060115|10.384006|8.791657|6.026138|8.540112|8.654797|4.788753|3.589830|6.056868|4.071880|2.469709|2.298232|1.970353|1.818064|1.897681|2.187891|2.232329|3.044290|0.124514|0.217043|0.500000|
|8.958647|5.657969|4.982385|5.653317|8.922353|17.698764|7.112736|4.611208|3.918235|4.071853|3.287206|5.595594|3.819291|2.854177|4.436123|4.706735|2.345474|2.125905|3.908819|2.532932|1.677193|1.661223|1.495646|1.377856|1.386210|1.515224|1.495438|2.004723|0.216135|0.124246|0.108009|0.500000|
|4.554728|3.998172|4.398011|6.107454|8.936458|6.535018|17.505485|8.891612|6.785005|5.405925|4.176719|7.266768|4.506437|3.263607|4.880602|5.548218|2.721559|2.579279|4.968486|2.992879|1.994225|2.026512|1.806018|1.624801|1.607461|1.756981|1.689104|2.217611|0.106722|0.090951|0.101921|0.180365|0.500000|
|4.754714|3.998850|4.240825|5.688943|8.913489|7.164943|17.552064|8.817535|5.542729|4.856065|3.591228|5.907186|4.143222|3.198905|4.907634|5.596125|2.494758|2.348364|4.502876|2.742014|1.832429|1.861318|1.669446|1.508609|1.492580|1.624832|1.567851|2.066402|0.112785|0.090965|0.097499|0.215340|0.304033|0.500000|
|3.252140|3.098273|3.576904|4.843597|5.505781|4.108614|8.843898|17.556858|8.850834|5.498694|4.117178|6.691401|4.733242|3.640076|5.502153|6.349206|2.850093|2.845504|5.803377|3.240764|2.190698|2.301177|2.042042|1.793216|1.739193|1.890423|1.772761|2.287621|0.078296|0.073468|0.089138|0.110534|0.219577|0.208222|0.500000|
|3.736677|3.636735|4.335414|6.091023|6.606116|4.693807|8.825173|17.512533|8.832699|6.933366|4.543225|6.812695|5.434128|4.568335|6.814955|8.990658|3.116710|2.985888|5.972655|3.350313|2.214805|2.279270|2.000633|1.769031|1.737865|1.911009|1.814219|2.358969|0.087754|0.084812|0.106753|0.119980|0.174116|0.216658|0.303684|0.500000|
|3.626098|3.707669|4.649080|6.606440|6.164505|4.346291|7.105769|8.877643|17.556115|8.902404|7.317687|12.701131|6.877501|4.589306|6.405047|7.693141|3.957422|3.854169|7.827490|4.190938|2.718799|2.781276|2.377227|2.077920|2.050803|2.293931|2.160903|2.783385|0.084553|0.086994|0.118207|0.107354|0.206288|0.142435|0.210429|0.173579|0.500000|
|3.103757|3.250097|4.102161|5.505216|4.870110|3.589442|5.525148|8.766201|17.580354|8.896721|6.971020|10.200355|7.803892|5.807613|8.018403|10.003889|4.375772|4.505457|10.024529|4.682671|3.037002|3.189334|2.670170|2.275841|2.218061|2.489726|2.296638|2.915207|0.073579|0.078204|0.109923|0.089613|0.140738|0.123204|0.213824|0.208468|0.302189|0.500000|
|3.824005|4.266531|5.639052|6.847512|5.365423|4.148824|4.835551|5.895436|6.358551|8.748226|5.853770|7.699352|8.288923|9.344926|13.004191|26.085144|4.286992|3.747145|7.115314|4.063152|2.554481|2.520759|2.152743|1.919370|1.933035|2.187247|2.118513|2.781893|0.088724|0.102095|0.154382|0.098343|0.109141|0.119191|0.127877|0.201495|0.132655|0.168531|0.500000|
|2.531886|2.999357|3.709130|3.576782|2.850098|2.488809|2.585302|2.850662|3.534859|4.357801|5.758543|8.812430|12.640235|7.251792|13.172364|6.642661|17.613508|8.865154|10.997177|9.687017|4.732751|3.884915|3.061543|2.805680|3.075895|3.930406|4.092408|5.441811|0.062476|0.080961|0.125003|0.060972|0.067836|0.063975|0.071228|0.079468|0.092307|0.103128|0.113835|0.500000|
|2.693803|3.197108|3.985103|3.857024|3.051849|2.652524|2.749276|2.962721|3.813065|4.652432|7.208777|12.918604|12.628402|5.737739|8.856183|6.112913|17.606831|8.869673|11.010005|9.681064|4.732020|3.880562|3.059537|2.805648|3.077769|3.934252|4.101744|5.458464|0.066088|0.085579|0.133218|0.064660|0.074190|0.066665|0.074157|0.079116|0.105733|0.107897|0.102459|0.300306|0.500000|
|2.011538|2.280064|2.671297|2.659551|2.256835|2.005570|2.136694|2.345877|2.859738|3.149408|4.037772|7.139116|6.740856|4.035765|7.157653|4.410819|7.801578|9.470931|10.874189|26.012371|9.351060|5.746626|4.293031|4.062888|4.887726|7.591436|8.222462|9.572311|0.050747|0.061820|0.084044|0.050503|0.057990|0.053390|0.061150|0.063829|0.078644|0.085273|0.078663|0.214646|0.214283|0.500000|
|1.837217|1.981113|2.308244|2.494329|2.223328|1.924908|2.267979|2.648771|3.219136|3.093054|3.571097|6.213847|5.307948|3.556062|6.133378|4.294587|4.459125|6.927383|15.285064|9.581884|8.927680|17.841853|8.929796|5.626929|4.950149|5.650079|4.152637|4.627653|0.046290|0.051937|0.067929|0.049612|0.062111|0.056848|0.072723|0.071525|0.088213|0.105366|0.078040|0.110875|0.110648|0.143659|0.500000|
|1.493273|1.583261|1.784508|1.900372|1.749982|1.557574|1.800545|2.043301|2.339600|2.229834|2.463790|4.380375|3.547174|2.456235|4.337546|3.076625|2.894723|3.765844|7.278775|5.670607|5.660357|8.994891|17.720732|8.924494|5.678086|4.986337|3.620404|4.052255|0.038294|0.041984|0.051812|0.040864|0.049852|0.046194|0.057314|0.055426|0.064992|0.073487|0.058021|0.075841|0.075772|0.098280|0.217109|0.500000|
|1.326994|1.413038|1.567255|1.625916|1.498221|1.360874|1.512245|1.666378|1.880564|1.849580|2.058636|3.704255|2.984140|2.053816|3.680202|2.551513|2.492716|3.044350|5.390864|4.912710|4.910030|5.615680|8.881002|17.741502|8.931426|5.641999|4.162830|4.611536|0.034383|0.038048|0.045854|0.035758|0.041938|0.039100|0.046207|0.045361|0.052522|0.057094|0.048505|0.067362|0.067361|0.092127|0.123924|0.214353|0.500000|
|1.373180|1.484320|1.644679|1.667262|1.513735|1.385317|1.492836|1.620249|1.844400|1.877245|2.142562|3.878317|3.169797|2.138450|3.863466|2.595481|2.765793|3.270665|5.363526|5.722617|5.612930|4.942228|5.664069|8.912250|17.736505|8.945163|7.226153|7.485234|0.035628|0.040454|0.048937|0.036107|0.041260|0.038465|0.044118|0.044167|0.051526|0.055023|0.049034|0.076555|0.076624|0.116077|0.107505|0.124312|0.214025|0.500000|
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