Version2.2
2021-02-11T15:07:41Z
10.1021/jm300687e
Gaussian16
RevisionB.01
SBUNGAY
15-Dec-2020
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE c1cc(cc(c1)NC(=O)N[C@@H]2CCCN(C2)c3ncccn3)c4ccc(=O)[nH]n4 C66679491
RHF
6-31G(d)
(6D,7F)
c1cc(cc(c1)NC(=O)N[C@@H]2CCCN(C2)c3ncccn3)c4ccc(=O)[nH]n4
C01[X(C20H21N7O2)]
144
C1
477
O=C(Nc1cccc(c1)c1ccc(=O)[nH]n1)N[C@@H]1CCCN(C1)c1ncccn1
O=C(Nc1cccc(c1)c1ccc(=O)[nH]n1)N[C@@H]1CCCN(C1)c1ncccn1
O=C(N[C@@H]1CCCN(C1)c2ncccn2)Nc3cccc(c3)C4=NNC(=O)C=C4
InChIKey=TUAZUQWAZVSKJA-MRXNPFEDSA-N
InChI=1S/C20H21N7O2/c28-18-8-7-17(25-26-18)14-4-1-5-15(12-14)23-20(29)24-16-6-2-11-27(13-16)19-21-9-3-10-22-19/h1,3-5,7-10,12,16H,2,6,11,13H2,(H,26,28)(H2,23,24,29)/t16-/m1/s1
InChI=1/C20H21N7O2/c28-18-8-7-17(25-26-18)14-4-1-5-15(12-14)23-20(29)24-16-6-2-11-27(13-16)19-21-9-3-10-22-19/h1,3-5,7-10,12,16H,2,6,11,13H2,(H,26,28)(H2,23,24,29)/t16-/m1/s1/f/h23-24,26H
c1cc(cc(c1)NC(=O)N[C@@H]2CCCN(C2)c3ncccn3)c4ccc(=O)[nH]n4
C01[X(C20H21N7O2)]
144
C01
477
O=C(Nc1cccc(c1)c1ccc(=O)[nH]n1)N[C@@H]1CCCN(C1)c1ncccn1
O=C(N[C]1[CH][CH][CH][C]([CH]1)c1ccc(=O)[nH]n1)N[C@@H]1CCC[N@@](C1)[C]1[N][CH][CH][CH][N]1
O=C(N[C]1[CH][CH][CH][C]([CH]1)C2=NNC(=O)C=C2)N[C@@H]3CCCN(C3)[C]4[N][CH][CH][CH][N]4
InChIKey=TUAZUQWAZVSKJA-MRXNPFEDSA-N
InChI=1S/C20H21N7O2/c28-18-8-7-17(25-26-18)14-4-1-5-15(12-14)23-20(29)24-16-6-2-11-27(13-16)19-21-9-3-10-22-19/h1,3-5,7-10,12,16H,2,6,11,13H2,(H,26,28)(H2,23,24,29)/t16-/m1/s1
InChI=1/C20H21N7O2/c28-18-8-7-17(25-26-18)14-4-1-5-15(12-14)23-20(29)24-16-6-2-11-27(13-16)19-21-9-3-10-22-19/h1,3-5,7-10,12,16H,2,6,11,13H2,(H,26,28)(H2,23,24,29)/t16-/m1/s1/f/h23-24,26H
2514.0011350494
-1300.4913372
1-A
18616.3450
103
374
477
|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|
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10.58025
-3.1294 -6.0829 -3.6226
7.7406
|XX|YY|ZZ|XY|XZ|YZ|
-165.9484 -155.8995 -167.8896 -24.7481 -15.2294 -2.1862
|XX|YY|ZZ|XY|XZ|YZ|
-2.7026 7.3463 -4.6437 -24.7481 -15.2294 -2.1862
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
-86.9854 -99.5815 26.0821 -182.5405 -129.2367 -106.7459 3.4602 8.7833 -59.1518 -12.1423
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
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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 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144
|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|A|A|A|A|A|A|A|A|A|A|A|A|
4.1347 16.2694 28.4596 34.3271 42.8282 53.4392 62.7007 67.9031 85.5366 95.9568 132.3458 170.0671 178.0747 202.4228 216.1068 240.5480 267.0951 275.6398 307.5529 326.1320 336.0122 344.5973 368.7902 382.9374 392.6317 405.5484 454.7764 459.5527 483.2444 485.3296 500.1434 525.9069 531.4756 555.5778 569.7624 582.5514 596.9430 638.1203 669.3447 672.5045 696.1532 702.4095 721.5272 767.2648 777.0129 785.0843 834.6288 844.0241 845.6829 856.5884 877.0975 888.1037 889.6374 909.8862 925.1035 944.1006 954.0532 970.3875 988.8348 1002.8033 1040.0590 1049.6988 1061.4870 1083.7313 1086.5423 1087.6106 1091.0489 1097.7151 1120.9976 1141.5334 1142.6254 1146.1728 1152.8270 1165.2722 1175.3755 1192.1687 1216.3883 1223.5299 1227.6414 1240.1895 1257.0693 1269.7666 1278.8870 1281.7253 1320.2864 1324.6052 1342.7243 1357.8535 1364.7463 1374.4021 1407.5587 1421.3743 1423.2364 1436.3244 1450.9927 1460.8807 1466.1979 1474.5132 1516.0679 1530.4037 1537.1359 1549.6793 1569.0093 1577.8368 1605.8578 1613.8235 1621.3679 1631.0084 1636.3874 1647.9643 1651.2423 1651.8149 1668.3668 1702.2252 1737.7577 1767.9144 1768.1971 1792.1125 1815.1941 1818.3036 1858.0592 1954.6089 1966.7255 3135.3903 3151.1137 3166.9055 3209.8002 3246.9646 3251.4127 3303.8054 3345.4381 3360.1992 3364.2298 3367.9828 3369.5983 3379.4217 3386.1383 3398.4520 3416.5778 3419.1923 3478.6196 3854.9280 3876.2005 3879.5271
5.8245 5.7665 5.5723 4.8976 5.2535 7.0426 6.4585 4.4237 6.9379 4.3478 5.1149 6.1275 4.5326 5.0864 5.2312 3.0442 2.9466 2.4723 6.5021 1.6450 4.9053 3.6691 4.4491 2.8444 5.0597 5.1983 5.0114 4.1510 3.2741 2.7883 3.2546 1.4794 3.3805 2.8932 2.9707 2.8436 2.1645 8.3341 5.6979 4.7890 4.9550 7.6183 3.8165 1.5576 1.8780 5.6736 4.3644 5.9682 4.7817 5.1654 1.2090 7.0066 1.7063 9.6399 2.6995 1.3863 1.8387 2.9934 3.3743 1.4528 2.1563 1.4353 2.2303 5.3655 3.6628 3.4252 2.9967 1.3282 1.4671 1.3789 1.4772 2.7241 2.2563 2.4666 2.1594 2.1426 2.0350 2.7218 2.7589 2.7839 1.3209 2.6516 1.9590 1.6475 1.4406 1.8326 2.0565 2.4739 2.3477 1.5063 1.4507 1.2929 3.0489 3.5709 1.5441 1.3149 1.3541 1.3046 1.4636 1.4287 1.5527 1.5799 2.2582 1.6870 1.8945 3.0421 2.3775 1.0957 1.6236 1.6142 1.1928 1.7505 1.2445 1.6999 2.0845 5.6212 6.3380 4.9520 4.5984 5.5019 7.1813 7.6547 8.1976 1.0753 1.0760 1.0730 1.0622 1.0946 1.1023 1.0877 1.0895 1.0911 1.0930 1.0908 1.0899 1.0904 1.0970 1.0899 1.0980 1.0996 1.0924 1.0779 1.0798 1.0775
0.0001 0.0009 0.0027 0.0034 0.0057 0.0118 0.0150 0.0120 0.0299 0.0236 0.0528 0.1044 0.0847 0.1228 0.1439 0.1038 0.1239 0.1107 0.3624 0.1031 0.3263 0.2567 0.3565 0.2458 0.4596 0.5037 0.6107 0.5165 0.4505 0.3870 0.4797 0.2411 0.5626 0.5262 0.5682 0.5686 0.4544 1.9995 1.5041 1.2761 1.4148 2.2146 1.1706 0.5403 0.6680 2.0604 1.7913 2.5050 2.0149 2.2330 0.5480 3.2560 0.7957 4.7022 1.3612 0.7280 0.9861 1.6608 1.9439 0.8608 1.3743 0.9318 1.4806 3.7128 2.5478 2.3872 2.1018 0.9429 1.0862 1.0587 1.1363 2.1085 1.7667 1.9733 1.7576 1.7942 1.7741 2.4007 2.4498 2.5227 1.2298 2.5189 1.8878 1.5947 1.4796 1.8945 2.1845 2.6874 2.5763 1.6764 1.6934 1.5390 3.6387 4.3405 1.9154 1.6534 1.7150 1.6711 1.9821 1.9715 2.1616 2.2355 3.2753 2.4746 2.8784 4.6681 3.6824 1.7173 2.5616 2.5829 1.9162 2.8141 2.0409 2.9021 3.7088 10.3515 11.6751 9.3704 8.9269 10.7176 14.6074 17.2305 18.6820 6.2280 6.2951 6.3404 6.4478 6.7993 6.8658 6.9952 7.1843 7.2584 7.2884 7.2903 7.2909 7.3368 7.4111 7.4168 7.5518 7.5740 7.7885 9.4375 9.5589 9.5549
0.2146 0.1348 0.5421 6.9937 1.0457 3.6935 1.5080 2.5794 1.0180 0.2170 2.1618 4.5434 7.0502 0.7220 1.6325 12.2567 4.7660 3.1679 5.8855 17.0980 0.3229 13.3147 3.4899 13.6705 30.1236 0.4190 1.2220 0.1461 15.3203 10.0532 25.1587 120.2342 15.8660 31.1866 7.2644 5.2247 17.9838 32.9354 8.1710 5.5527 4.8568 6.8968 3.2717 43.6727 71.5505 2.3850 1.6212 15.0004 20.3498 12.9944 38.6592 23.5282 53.1142 39.6946 6.0808 12.0440 57.1962 11.8608 6.2706 2.6908 8.4175 20.4278 48.5172 3.1662 7.4236 42.1088 28.2348 0.3401 0.1197 0.1197 1.3877 3.8611 19.0838 4.1004 33.9044 6.0504 17.1874 28.1303 13.4846 18.4244 46.9311 0.6665 43.5985 3.4163 41.1774 26.3286 323.5790 120.8311 129.6268 35.0213 196.1558 33.1594 26.6844 77.2126 5.2281 31.7481 25.9774 11.3540 51.7568 9.4106 81.9549 12.9795 47.3471 0.5096 61.2214 192.2086 4.3819 4.0216 442.7366 301.8197 25.3839 26.1584 92.0352 302.8611 717.2671 78.8211 149.2960 167.4195 39.5021 454.1457 78.8515 311.2045 829.9571 39.9371 58.9524 77.3440 37.7328 61.2676 53.0378 12.5525 15.5126 30.1481 43.3249 25.1942 2.7689 2.6930 20.4957 6.0714 11.1801 3.6585 9.9058 13.4672 82.6068 35.1924
4.1531 3.0727 1.2146 2.5439 4.1486 1.4574 3.7488 2.0293 0.3288 1.3345 1.0013 1.2411 2.1280 1.2874 0.9753 0.6792 2.5275 0.2312 1.4105 0.8522 7.2205 2.6152 1.8026 1.1269 0.7700 2.8509 0.3709 1.0214 1.3188 0.9170 0.9547 1.6733 1.7019 1.2271 0.1403 0.4534 2.3028 0.4808 3.6324 2.8691 1.7086 2.7976 2.5597 1.7763 1.8579 6.5833 6.4301 4.7260 0.8633 4.0390 0.5257 9.8443 1.4228 1.2433 2.2844 1.1392 2.7203 6.1057 5.6769 3.2960 3.4441 1.4869 3.9318 51.7271 16.9304 3.9455 10.3083 1.1103 2.9584 2.1235 4.4954 4.5774 18.8164 9.3261 2.4010 11.1073 1.9642 6.7609 9.6171 2.3794 11.5254 4.0286 2.7178 5.1017 2.3339 1.4647 3.3125 17.1682 30.1059 5.7757 5.6537 14.8833 43.4837 35.0647 0.4943 3.9833 5.6640 5.3630 4.6755 5.9497 4.1065 3.5273 21.6088 1.3396 18.0313 107.4169 0.9596 18.4042 43.5993 4.1025 12.2092 3.3641 0.5088 9.5920 20.0653 60.8988 8.0431 62.5330 108.0364 71.6127 96.6920 24.0169 15.8980 33.3751 71.7663 117.5479 98.3602 147.4346 76.0608 30.5295 74.9843 147.3925 87.2635 85.1488 45.3489 30.0778 173.8900 53.4199 168.0052 134.9122 26.4710 20.9143 91.2430 77.1396
0.7496 0.7406 0.7487 0.7500 0.7326 0.7461 0.7407 0.7435 0.7500 0.6697 0.7499 0.6931 0.7388 0.2129 0.1780 0.7495 0.7324 0.5450 0.6772 0.7245 0.7042 0.2345 0.2758 0.1236 0.6351 0.6946 0.6374 0.7483 0.6756 0.2333 0.5735 0.2633 0.3163 0.4434 0.7491 0.3993 0.7192 0.3017 0.7237 0.6012 0.7132 0.7318 0.6062 0.5720 0.7493 0.3711 0.2053 0.2610 0.2267 0.2053 0.7046 0.1188 0.2113 0.5818 0.2468 0.2831 0.7483 0.1292 0.3845 0.3419 0.1447 0.7495 0.4349 0.1142 0.3510 0.6412 0.1153 0.6858 0.7364 0.7496 0.7304 0.5158 0.2484 0.1324 0.6869 0.2107 0.1415 0.2632 0.5477 0.6265 0.6331 0.6483 0.6059 0.6215 0.4248 0.7346 0.7380 0.1509 0.5461 0.7383 0.4279 0.7324 0.1290 0.1812 0.4412 0.5180 0.4945 0.5784 0.7281 0.6896 0.5090 0.7500 0.3455 0.2744 0.2047 0.2382 0.7006 0.7495 0.6322 0.2660 0.5974 0.7485 0.7043 0.4665 0.6490 0.1772 0.1237 0.3130 0.7250 0.4140 0.2969 0.2560 0.4753 0.2905 0.2866 0.2126 0.2096 0.3026 0.7425 0.2105 0.4842 0.2727 0.6736 0.6188 0.2820 0.2163 0.1583 0.5629 0.2017 0.1758 0.2273 0.2348 0.2529 0.1491
0.8569 0.8510 0.8563 0.8571 0.8456 0.8546 0.8510 0.8529 0.8571 0.8021 0.8571 0.8187 0.8498 0.3511 0.3022 0.8568 0.8456 0.7055 0.8076 0.8402 0.8264 0.3799 0.4324 0.2200 0.7769 0.8198 0.7785 0.8561 0.8064 0.3784 0.7289 0.4168 0.4805 0.6144 0.8566 0.5707 0.8366 0.4636 0.8397 0.7509 0.8326 0.8451 0.7548 0.7278 0.8567 0.5413 0.3407 0.4139 0.3696 0.3407 0.8267 0.2123 0.3489 0.7356 0.3959 0.4413 0.8560 0.2288 0.5555 0.5096 0.2528 0.8568 0.6061 0.2049 0.5196 0.7814 0.2068 0.8136 0.8482 0.8569 0.8442 0.6806 0.3979 0.2339 0.8144 0.3481 0.2480 0.4167 0.7078 0.7704 0.7754 0.7866 0.7546 0.7666 0.5963 0.8470 0.8492 0.2623 0.7064 0.8494 0.5993 0.8455 0.2285 0.3068 0.6123 0.6825 0.6618 0.7329 0.8427 0.8163 0.6746 0.8571 0.5136 0.4307 0.3398 0.3848 0.8239 0.8568 0.7746 0.4202 0.7480 0.8562 0.8265 0.6362 0.7871 0.3011 0.2202 0.4768 0.8406 0.5855 0.4578 0.4077 0.6443 0.4502 0.4455 0.3506 0.3465 0.4647 0.8522 0.3478 0.6525 0.4286 0.8050 0.7645 0.4399 0.3556 0.2733 0.7203 0.3358 0.2990 0.3705 0.3804 0.4037 0.2595
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 47 48 49 50
6 6 6 6 6 6 7 6 8 7 6 1 6 6 6 7 6 6 7 6 6 6 7 6 6 6 6 8 7 1 7 1 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 14.00307 12.00000 15.99491 14.00307 12.00000 1.00783 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 1.00783 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 1.00783
7818.0137 27376.0282 33255.1746
0.99998 -0.00052 -0.00568 0.00049 0.99999 -0.00542 0.00569 0.00542 0.99997
1
0.01108 0.00316 0.00260
0.23084 0.06592 0.05427
5.95 23.41 40.95 49.39 61.62 76.89 90.21 97.70 123.07 138.06 190.42 244.69 256.21 291.24 310.93 346.09 384.29 396.58 442.50 469.23 483.45 495.80 530.61 550.96 564.91 583.49 654.32 661.19 695.28 698.28 719.59 756.66 764.67 799.35 819.76 838.16 858.87 918.11 963.04 967.58 1001.61 1010.61 1038.12 1103.92 1117.95 1129.56 1200.84 1214.36 1216.75 1232.44 1261.95 1277.78 1279.99 1309.12 1331.02 1358.35 1372.67 1396.17 1422.71 1442.81 1496.41 1510.28 1527.24 1559.25 1563.29 1564.83 1569.78 1579.37 1612.87 1642.41 1643.98 1649.09 1658.66 1676.57 1691.10 1715.26 1750.11 1760.39 1766.30 1784.36 1808.64 1826.91 1840.03 1844.12 1899.60 1905.81 1931.88 1953.65 1963.57 1977.46 2025.16 2045.04 2047.72 2066.55 2087.65 2101.88 2109.53 2121.50 2181.28 2201.91 2211.60 2229.64 2257.45 2270.16 2310.47 2321.93 2332.79 2346.66 2354.40 2371.05 2375.77 2376.59 2400.41 2449.12 2500.25 2543.63 2544.04 2578.45 2611.66 2616.13 2673.33 2812.25 2829.68 4511.13 4533.75 4556.47 4618.19 4671.66 4678.06 4753.44 4813.34 4834.58 4840.38 4845.78 4848.10 4862.23 4871.90 4889.61 4915.69 4919.46 5004.96 5546.38 5576.99 5581.77
0.435017
0.458144
0.459088
0.376490
-1300.056320
-1300.033193
-1300.032249
-1300.114847
2.770350D-04
MUNgauss
RevisionA2.1
retrievium
11-Feb-2021
DUDE c1cc(cc(c1)NC(=O)N[C@@H]2CCCN(C2)c3ncccn3)c4ccc(=O)[nH]n4 C66679491
RHF
6-31G(d)
(6D,10F)
C1
391.175673
|X|Y|Z|
61.763245 26.006561 118.849734
57.579835
27
|36.858105|
|13.762458|36.858105|
|7.956610|13.719498|36.858105|
|6.868344|7.894480|13.688184|36.858105|
|7.916152|6.836147|7.917054|13.718572|36.858105|
|13.813767|7.941825|6.888010|7.929936|13.666684|36.858105|
|5.206028|4.547125|5.119963|7.724729|13.557533|7.996801|53.358707|
|3.889920|3.664280|4.303417|6.267159|7.607448|5.144092|18.867640|36.858105|
|3.606810|3.614766|4.497883|6.595383|6.512479|4.441005|11.394807|15.877026|73.516695|
|3.206035|2.966558|3.311521|4.352506|5.222800|4.110136|11.344987|13.945858|15.021167|53.358707|
|2.609089|2.488114|2.787657|3.500232|3.855810|3.158069|7.097686|7.746040|12.154257|17.836503|36.858105|
|2.563262|2.498659|2.855222|3.589603|3.781063|3.048540|6.639569|7.398268|13.725593|12.659817|17.636519|0.500000|
|2.292239|2.160988|2.350927|2.835386|3.148980|2.729089|5.533397|5.158976|8.099492|10.639456|12.479942|0.246904|36.858105|
|1.961232|1.881769|2.047939|2.407274|2.577863|2.266123|4.277660|3.862815|6.551556|6.849168|7.597608|0.189956|12.466956|36.858105|
|1.887664|1.823420|1.988267|2.321622|2.456311|2.162499|4.013353|3.587545|6.193125|6.109065|6.531894|0.159417|7.547744|12.484415|36.858105|
|2.055356|2.007524|2.230501|2.645340|2.754353|2.362429|4.517937|4.208173|7.534267|6.937529|7.758148|0.193643|6.599957|7.782047|13.091994|53.358707|
|2.424258|2.340168|2.620599|3.217810|3.442110|2.868156|5.967776|5.928107|10.054968|10.521146|12.429863|0.248055|7.545657|6.546570|7.769107|17.852403|36.858105|
|1.909519|1.894422|2.112276|2.456911|2.487367|2.149755|3.917628|3.526666|6.574933|5.351309|5.215017|0.141865|4.495294|5.224789|7.754403|19.006373|7.768048|36.858105|
|1.686710|1.675600|1.847538|2.105596|2.125836|1.873864|3.284893|2.863905|5.303006|4.314416|4.044759|0.111768|3.817280|4.730852|6.930200|11.239828|5.221655|14.303514|53.358707|
|1.579532|1.584169|1.745815|1.959166|1.948815|1.730359|2.941903|2.511877|4.709635|3.656999|3.255542|0.091359|3.040606|3.577846|4.689295|7.415596|4.047024|8.442724|19.712824|36.858105|
|1.627832|1.649363|1.830784|2.044211|2.001964|1.770518|2.977078|2.525932|4.815178|3.565324|3.073667|0.086864|2.760995|3.076156|3.841245|6.413944|3.845987|7.111387|10.919922|13.787422|36.858105|
|1.837770|1.867288|2.099230|2.378901|2.316447|2.014443|3.464150|2.987275|5.780627|4.153598|3.570230|0.100680|3.039070|3.255285|4.045351|7.416471|4.701082|8.443153|9.648880|8.185219|13.778643|36.858105|
|2.018619|2.028346|2.291163|2.666323|2.641216|2.258210|4.080800|3.653715|7.033483|5.219834|4.711952|0.130555|3.813429|4.043152|5.222575|11.241489|6.956969|14.310480|10.994030|7.092268|8.025053|14.492007|53.358707|
|5.061806|7.629060|12.785399|7.660255|5.059766|4.476438|5.235133|3.536259|6.922281|3.840451|2.491543|0.072244|2.117134|1.893504|1.853748|2.839384|2.385715|2.018912|2.427753|1.710263|1.812949|2.069361|3.009196|36.858105|
|4.337012|6.273466|7.425603|5.083389|3.875077|3.686447|4.203643|2.851200|5.449449|3.227517|2.131523|0.061109|1.845517|1.674815|1.657656|2.520048|2.083237|1.815489|2.209698|1.574922|1.678868|1.898370|2.710705|13.098233|36.858105|
|3.336559|4.389189|5.042775|3.930887|3.118750|2.947760|3.555229|2.488802|4.814328|2.877686|1.946348|0.056239|1.699891|1.566990|1.556915|2.361497|1.916506|1.722400|2.117803|1.524975|1.633591|1.831168|2.574099|7.887975|14.288680|36.858105|
|2.939044|3.709773|4.452242|3.741526|2.951623|2.704467|3.459299|2.498152|4.960661|2.892667|1.989443|0.058468|1.733974|1.612106|1.596295|2.428003|1.949826|1.780137|2.195255|1.585577|1.700699|1.900963|2.659785|6.830301|7.871999|13.032231|36.858105|
|2.481471|3.012281|3.478963|3.052701|2.501736|2.312071|3.012442|2.203680|4.359425|2.603594|1.819526|0.053566|1.603237|1.509306|1.498879|2.267736|1.793314|1.677182|2.091068|1.523272|1.636469|1.808505|2.497944|4.777669|5.380783|8.032171|15.846817|73.516695|
|3.209426|4.061676|5.279044|4.575541|3.440165|3.028725|4.009180|2.934531|5.998950|3.318897|2.271357|0.067748|1.951571|1.799504|1.765838|2.704797|2.192205|1.965619|2.400323|1.717204|1.833717|2.067181|2.934501|8.490767|7.173368|8.089237|13.941979|15.084735|53.358707|
|2.854927|3.466276|4.385353|4.068770|3.159484|2.760611|3.805944|2.859969|5.933926|3.272243|2.279898|0.068974|1.964955|1.828966|1.788498|2.737379|2.191494|1.997056|2.451012|1.757269|1.873549|2.099829|2.969025|6.126990|5.217264|5.827082|9.401978|13.775211|26.026735|0.500000|
|4.038829|5.344032|8.025453|6.667143|4.516816|3.825961|4.997284|3.574443|7.353398|3.883619|2.578623|0.076701|2.179954|1.967575|1.915950|2.947964|2.448773|2.105322|2.534934|1.788243|1.896619|2.162278|3.137127|14.950759|8.030326|6.874165|7.841960|9.670797|19.425927|0.268566|53.358707|
|17.718876|8.920905|5.651585|4.949759|5.640805|8.961096|5.752353|3.277304|5.383318|3.838381|2.335154|0.063344|2.099039|1.810910|1.744369|2.552724|2.182583|1.747064|2.121645|1.464103|1.503624|1.681247|2.495974|4.114473|3.769497|2.998563|2.629927|4.021516|3.808203|0.069804|4.592519|0.500000|
|8.937971|17.728136|8.867484|5.617487|4.933984|5.656213|4.926309|3.042774|5.397412|3.459907|2.185320|0.061135|1.927307|1.703170|1.656314|2.465491|2.075226|1.725843|2.099705|1.469970|1.533127|1.720621|2.512017|7.012525|6.863813|4.764563|3.830256|5.542223|5.420707|0.093475|6.707075|0.215676|0.500000|
|4.959654|5.640048|8.922815|17.846650|8.921298|5.647618|9.527747|6.862335|15.229071|6.269913|3.835128|0.113075|3.007669|2.577865|2.495905|3.956443|3.540153|2.717366|3.133560|2.141129|2.248921|2.651051|4.069370|7.111211|4.751262|3.887403|3.908296|5.703408|6.812902|0.127386|9.943524|0.107640|0.123884|0.500000|
|8.948865|5.651019|4.957810|5.637806|8.882963|17.691847|10.044296|4.821282|7.096711|5.636584|3.149260|0.082495|2.797697|2.297580|2.180553|3.187465|2.841996|2.108017|2.513159|1.695161|1.718201|1.940177|2.970864|3.572516|3.063971|2.532421|2.345874|3.635381|3.526913|0.066679|4.297404|0.216684|0.124480|0.124041|0.500000|
|4.955661|4.094420|4.294644|5.757833|9.385316|7.720091|26.086499|9.414229|10.858403|10.873108|4.963508|0.123546|4.140955|3.139317|2.915076|4.324742|4.143747|2.724132|3.149390|2.063490|2.064461|2.368099|3.782040|3.301951|2.747862|2.348002|2.270158|3.556339|3.509667|0.068242|4.259605|0.117323|0.092784|0.143384|0.237434|0.500000|
|3.215230|2.889418|3.118813|3.978796|4.981430|4.175051|10.681030|9.362070|10.896418|26.044175|9.089636|0.180996|7.214890|4.678135|4.250327|6.247933|6.656947|3.588433|4.023165|2.519717|2.447550|2.815533|4.733170|2.630642|2.250894|2.000724|1.983896|3.181962|3.048846|0.060856|3.545145|0.079876|0.069044|0.111783|0.122723|0.247631|0.500000|
|2.287815|2.123588|2.270843|2.712867|3.079899|2.737232|5.422963|4.744963|7.165194|9.777603|8.860005|0.174181|17.463069|8.862342|6.781069|7.847206|6.771199|4.091523|4.796871|2.847990|2.599337|2.850539|4.803235|2.026289|1.784171|1.636578|1.650234|2.710858|2.501571|0.050952|2.794659|0.058753|0.052683|0.078189|0.079667|0.117549|0.217391|0.500000|
|2.320115|2.178835|2.357765|2.831320|3.159823|2.761639|5.501509|4.980890|7.812336|9.643609|8.853216|0.215918|17.556051|8.784134|5.489746|6.708100|5.501240|3.675997|4.394912|2.659660|2.441486|2.657832|4.389359|2.116860|1.835841|1.690012|1.728690|2.840652|2.659569|0.054807|2.978951|0.059159|0.054013|0.082722|0.078945|0.115646|0.181190|0.302444|0.500000|
|1.819967|1.737769|1.866338|2.159864|2.322032|2.085863|3.788461|3.279368|5.511014|5.657324|5.518069|0.139781|8.823932|17.538999|8.879925|7.672642|4.901226|4.226711|5.543371|3.192908|2.734449|2.821060|4.581919|1.728198|1.542271|1.447067|1.484090|2.480808|2.237088|0.046352|2.432006|0.047166|0.043992|0.063351|0.059317|0.078613|0.112182|0.215861|0.209516|0.500000|
|1.919886|1.865122|2.048691|2.401377|2.518752|2.197340|4.104301|3.743332|6.632347|6.271469|6.809932|0.200444|8.852278|17.534918|8.900271|9.467361|5.728127|5.100650|6.436845|3.635645|3.124944|3.275964|5.443648|1.917671|1.689586|1.591378|1.655581|2.766022|2.531152|0.053032|2.751068|0.049081|0.047023|0.072386|0.061094|0.082011|0.114327|0.173798|0.214328|0.302462|0.500000|
|1.869571|1.787798|1.925704|2.235035|2.399315|2.145616|3.923019|3.397159|5.691597|5.834193|5.709637|0.132283|6.768020|8.843937|17.450951|12.410803|6.945772|6.315947|7.843663|4.182087|3.511821|3.694928|6.320044|1.781958|1.605387|1.502184|1.524926|2.542557|2.277638|0.046716|2.475303|0.048316|0.045166|0.065699|0.060836|0.080745|0.119092|0.198850|0.138780|0.216275|0.174024|0.500000|
|1.717587|1.672564|1.820150|2.093066|2.181424|1.938550|3.472832|3.039705|5.370019|4.928456|4.910791|0.129000|5.509024|8.842153|17.719534|12.516927|5.669271|7.484173|11.357631|5.387219|4.097681|4.050138|6.703678|1.720028|1.551163|1.470579|1.515157|2.549800|2.268381|0.047134|2.430844|0.044310|0.042559|0.062542|0.054070|0.069794|0.095394|0.139316|0.123288|0.211633|0.217102|0.302451|0.500000|
|2.563491|2.518090|2.882273|3.583666|3.711364|3.014225|6.274919|6.335193|11.702791|9.491964|8.873782|0.218953|5.522325|4.925512|5.662529|12.497015|17.725559|7.468353|6.694215|4.046717|4.094836|5.383191|11.328744|2.643532|2.293940|2.106412|2.147306|3.490766|3.304828|0.067230|3.706339|0.063346|0.061752|0.112686|0.080988|0.115496|0.162264|0.139344|0.123933|0.108176|0.129070|0.142532|0.127845|0.500000|
|2.429410|2.305572|2.528957|3.067190|3.374163|2.889476|5.864797|5.370078|8.513511|9.699064|8.844311|0.174614|6.767003|5.711053|6.929976|12.386543|17.430644|6.310565|6.280457|3.681685|3.511909|4.201045|7.909812|2.274854|2.011582|1.840727|1.845823|3.016357|2.788202|0.056302|3.115399|0.061327|0.056872|0.090810|0.081168|0.117831|0.197511|0.198570|0.139081|0.128056|0.131906|0.204451|0.142532|0.301514|0.500000|
|1.453015|1.456077|1.592499|1.769288|1.762520|1.581900|2.641168|2.222836|4.137014|3.235903|2.836395|0.079635|2.734458|3.248761|4.112617|5.980270|3.376714|5.920764|12.769549|17.689354|8.887844|5.727600|6.892367|1.564894|1.450268|1.410869|1.467467|2.521409|2.150383|0.044988|2.225387|0.037637|0.037743|0.053289|0.043201|0.051839|0.062513|0.071685|0.067552|0.083154|0.092148|0.103891|0.135684|0.092339|0.087052|0.500000|
|1.525492|1.553721|1.717268|1.890418|1.838847|1.641459|2.693079|2.245410|4.278462|3.128799|2.630108|0.074533|2.390837|2.631772|3.173062|5.069682|3.176462|5.078923|7.745863|8.827867|17.770608|8.824815|7.747289|1.717875|1.608752|1.579529|1.646617|2.840988|2.391803|0.049926|2.444697|0.039313|0.040415|0.057461|0.044181|0.051971|0.060084|0.062999|0.059721|0.066225|0.074490|0.082056|0.094000|0.093956|0.082065|0.210641|0.500000|
|1.882581|1.933562|2.185713|2.453102|2.349117|2.043313|3.441119|2.917539|5.706393|3.929720|3.240830|0.091678|2.732636|2.834858|3.377026|5.981757|4.124309|5.921719|6.890400|5.727533|8.882710|17.691940|12.774297|2.181021|2.017594|1.955790|2.028307|3.432937|2.981130|0.061530|3.095158|0.047737|0.049645|0.076156|0.054179|0.064801|0.074214|0.071787|0.067486|0.069022|0.079239|0.087467|0.092408|0.135653|0.104602|0.124365|0.210507|0.500000|
|4.701729|6.833743|6.878397|4.727895|3.816609|3.817458|4.114503|2.727381|5.072057|3.123528|2.047210|0.057881|1.785865|1.616068|1.604483|2.425885|2.011065|1.743279|2.125326|1.513590|1.609869|1.816054|2.594944|8.707211|17.747896|9.084415|5.590141|7.605816|6.956151|0.112052|7.806542|0.116290|0.227415|0.117667|0.088545|0.075961|0.061422|0.048456|0.049241|0.041526|0.044924|0.043525|0.041643|0.061136|0.054656|0.038787|0.042881|0.053540|0.500000|
|2.972214|3.764814|4.070291|3.282184|2.715344|2.621929|3.151343|2.206770|4.213870|2.597804|1.769290|0.050802|1.561401|1.449008|1.446348|2.181081|1.755529|1.598942|1.980990|1.434578|1.538278|1.711186|2.384468|5.578035|8.988082|17.754559|8.776417|12.791069|7.802396|0.127214|6.745900|0.076220|0.116030|0.089613|0.063742|0.058663|0.050597|0.041979|0.043041|0.037367|0.040772|0.038933|0.038116|0.053289|0.047152|0.037041|0.041584|0.050852|0.214224|0.500000|
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