Version2.4
2021-05-09T00:38:22Z
10.1021/jm300687e
Gaussian16
RevisionB.01
SBUNGAY
23-Dec-2019
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE C[C@@H]1CCC2=NN([C@@]([C@@H]2C1)(C(F)(F)F)O)C(=O)c3ccc(cc3)Br C20034159
RHF
6-31G(d)
(6D,7F)
C[C@@H]1CCC2=NN([C@@]([C@@H]2C1)(C(F)(F)F)O)C(=O)c3ccc(cc3)Br
C01[X(C16H16Br1F3N2O2)]
114
C1
407
C[C@@H]1CCC2=NN([C@]([C@@H]2C1)(O)C(F)(F)F)C(=O)c1ccc(cc1)Br
C[C@@H]1CCC2=NN([C@]([C@@H]2C1)(O)C(F)(F)F)C(=O)c1ccc(cc1)Br
C[C@@H]1CCC2=NN(C(=O)c3ccc(Br)cc3)[C@@](O)([C@@H]2C1)C(F)(F)F
InChIKey=HXBUOUMGFKNLJN-DDHOLCJHSA-N
InChI=1S/C16H16BrF3N2O2/c1-9-2-7-13-12(8-9)15(24,16(18,19)20)22(21-13)14(23)10-3-5-11(17)6-4-10/h3-6,9,12,24H,2,7-8H2,1H3/t9-,12-,15-/m1/s1
InChI=1/C16H16BrF3N2O2/c1-9-2-7-13-12(8-9)15(24,16(18,19)20)22(21-13)14(23)10-3-5-11(17)6-4-10/h3-6,9,12,24H,2,7-8H2,1H3/t9-,12-,15-/m1/s1
C[C@@H]1CCC2=NN([C@@]([C@@H]2C1)(C(F)(F)F)O)C(=O)c3ccc(cc3)Br
C01[X(C16H16Br1F3N2O2)]
114
C01
407
C[C@@H]1CCC2=NN([C@]([C@@H]2C1)(O)C(F)(F)F)C(=O)c1ccc(cc1)Br
C[C@@H]1CCC2=NN([C@]([C@@H]2C1)(O)C(F)(F)F)C(=O)[C]1[CH][CH][C]([CH][CH]1)Br
C[C@@H]1CCC2=NN(C(=O)[C]3[CH][CH][C](Br)[CH][CH]3)[C@@](O)([C@@H]2C1)C(F)(F)F
InChIKey=HXBUOUMGFKNLJN-DDHOLCJHSA-N
InChI=1S/C16H16BrF3N2O2/c1-9-2-7-13-12(8-9)15(24,16(18,19)20)22(21-13)14(23)10-3-5-11(17)6-4-10/h3-6,9,12,24H,2,7-8H2,1H3/t9-,12-,15-/m1/s1
InChI=1/C16H16BrF3N2O2/c1-9-2-7-13-12(8-9)15(24,16(18,19)20)22(21-13)14(23)10-3-5-11(17)6-4-10/h3-6,9,12,24H,2,7-8H2,1H3/t9-,12-,15-/m1/s1
2603.2580102564
-3742.0507758
1-A
13023.5249
102
305
407
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
-490.06920 -64.48073 -58.62022 -58.61837 -58.61827 -26.34598 -26.34338 -26.34158 -20.58413 -20.55229 -15.63924 -15.62098 -11.50309 -11.37932 -11.36742 -11.30898 -11.29742 -11.26646 -11.25918 -11.25723 -11.25536 -11.25209 -11.25204 -11.25170 -11.24798 -11.24367 -11.24233 -11.22634 -9.72910 -7.47835 -7.46954 -7.46949 -3.21728 -3.21303 -3.21295 -3.20276 -3.20276 -1.74376 -1.64094 -1.63886 -1.44610 -1.40229 -1.36340 -1.18907 -1.17696 -1.13342 -1.09059 -1.07445 -1.04076 -1.03605 -1.00489 -0.98533 -0.93970 -0.91353 -0.87979 -0.85897 -0.85601 -0.83457 -0.83101 -0.81187 -0.80283 -0.79270 -0.77938 -0.74098 -0.71101 -0.70707 -0.69703 -0.67671 -0.66722 -0.66284 -0.65910 -0.65282 -0.64517 -0.64341 -0.63814 -0.63157 -0.62682 -0.61481 -0.61012 -0.60793 -0.59774 -0.58503 -0.58074 -0.56059 -0.54685 -0.54260 -0.53389 -0.52012 -0.51741 -0.51185 -0.50311 -0.49866 -0.48323 -0.47338 -0.46716 -0.44922 -0.44470 -0.43200 -0.41597 -0.36614 -0.35352 -0.33781
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
0.09006 0.12901 0.14028 0.16652 0.21168 0.22461 0.23458 0.25192 0.26472 0.27060 0.27709 0.28795 0.29201 0.29790 0.30260 0.31130 0.31503 0.31814 0.32859 0.33237 0.33655 0.33852 0.34245 0.35486 0.37733 0.37974 0.38634 0.39894 0.40806 0.42220 0.43836 0.44223 0.44516 0.45142 0.45920 0.47453 0.48001 0.48450 0.49553 0.50989 0.51506 0.52539 0.55165 0.56301 0.60199 0.62967 0.63792 0.64508 0.65026 0.66351 0.68180 0.68918 0.69136 0.69840 0.69984 0.70688 0.71424 0.72289 0.72982 0.73672 0.74828 0.75482 0.77096 0.78164 0.78948 0.79227 0.79964 0.80286 0.81052 0.81691 0.81874 0.83144 0.83815 0.86302 0.87057 0.88339 0.89140 0.91170 0.91882 0.92289 0.93415 0.94152 0.94257 0.96128 0.96773 0.97251 0.99061 0.99348 1.00400 1.01010 1.03121 1.03637 1.04756 1.06029 1.06609 1.07131 1.08661 1.09868 1.10050 1.10661 1.11577 1.11917 1.12054 1.12569 1.13377 1.14053 1.15291 1.16251 1.16420 1.16679 1.18447 1.18500 1.19243 1.19827 1.20909 1.21307 1.22685 1.23907 1.24646 1.25999 1.26447 1.27194 1.29089 1.30307 1.32107 1.33271 1.35240 1.35751 1.37793 1.38414 1.40506 1.41343 1.41811 1.42106 1.44532 1.45174 1.47063 1.47904 1.50290 1.51303 1.51843 1.54741 1.56443 1.58487 1.60989 1.63417 1.64130 1.64528 1.65568 1.66280 1.68076 1.68794 1.68911 1.70213 1.70628 1.71327 1.72069 1.73293 1.74285 1.74871 1.76383 1.77426 1.78611 1.79444 1.82099 1.83285 1.83635 1.84874 1.86761 1.91008 1.92781 1.94919 1.97535 1.97896 1.99102 2.00747 2.01453 2.03455 2.04527 2.05754 2.06712 2.07126 2.09115 2.09552 2.10955 2.11835 2.11963 2.12042 2.14427 2.14995 2.17578 2.18717 2.19583 2.21083 2.23084 2.23180 2.24469 2.25444 2.26335 2.26993 2.29953 2.30683 2.31130 2.31952 2.32270 2.33538 2.34712 2.35430 2.36361 2.38016 2.39022 2.39883 2.40778 2.42003 2.43656 2.44947 2.45125 2.45606 2.45999 2.47985 2.50245 2.51631 2.52829 2.54744 2.55994 2.58005 2.58355 2.59750 2.60046 2.62088 2.62776 2.63258 2.64879 2.65083 2.67777 2.69835 2.72015 2.73245 2.75593 2.77750 2.78767 2.81907 2.82935 2.83900 2.86139 2.88041 2.88412 2.91654 2.91876 2.95387 2.95528 2.98790 3.00158 3.00946 3.01981 3.03699 3.06298 3.09003 3.09431 3.11120 3.12473 3.13882 3.15106 3.16084 3.18739 3.21779 3.23535 3.26933 3.27560 3.31611 3.36280 3.38819 3.42663 3.45722 3.47752 3.51084 3.53785 3.58038 3.66015 3.81592 4.34843 4.45104 4.49447 4.50933 4.52811 4.54367 4.58822 4.63481 4.65832 4.67835 4.73216 4.74419 4.79355 4.91391 4.96953 4.98327 5.02921 5.03403 5.14387 5.30228 5.44490 5.63563 5.97591 9.27477 74.48347
11.64284
2.7779 4.1415 -0.7161
5.0380
|XX|YY|ZZ|XY|XZ|YZ|
-148.8030 -153.9019 -149.5139 13.3407 -0.2271 1.8675
|XX|YY|ZZ|XY|XZ|YZ|
1.9366 -3.1623 1.2257 13.3407 -0.2271 1.8675
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
-41.0586 6.8500 25.9592 -30.3559 15.7441 -11.9278 -48.1249 -5.3854 6.1173 -18.7535
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
-11845.4492 -2471.8928 -697.1767 -117.5152 30.2618 -235.7323 -20.0820 13.1882 -15.4008 -2362.3342 -2078.5367 -519.0706 27.3537 -11.2768 -69.6182
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404.03472
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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
24.0528 29.7670 39.5299 63.8210 88.6806 98.0644 109.9538 142.3678 167.1541 176.9176 202.8082 206.2525 240.0926 250.1270 262.8087 282.4163 306.5048 323.7344 335.5405 340.5233 349.1888 398.0315 417.2681 430.3997 438.0683 460.9054 487.1040 497.7794 525.4003 550.8680 568.8658 576.6914 608.0707 636.8943 666.6333 690.1776 714.2650 752.9484 758.4030 768.5201 786.7769 828.8274 842.0677 852.7368 896.6114 935.2128 951.0153 959.4033 965.0725 1008.1156 1030.2431 1052.2445 1075.1062 1094.3375 1107.2703 1111.8039 1118.6243 1138.1342 1178.6884 1185.0418 1198.3762 1210.3954 1224.1718 1241.8553 1270.1386 1272.7900 1285.7815 1290.0134 1310.0192 1337.0777 1351.7753 1371.4222 1384.8902 1388.8862 1408.3876 1432.7671 1454.6190 1458.6661 1473.7368 1494.0913 1497.7778 1528.2527 1531.0938 1546.6656 1552.1881 1554.9693 1567.9225 1591.3090 1622.7090 1636.6993 1644.0480 1645.2621 1652.0823 1669.8191 1761.6545 1799.8626 1898.0540 1954.9920 3168.6266 3193.8811 3198.1735 3202.7941 3228.4324 3247.0562 3247.2924 3262.4111 3268.2729 3283.9640 3295.0264 3401.2039 3403.6417 3417.4957 3433.5743 3977.8538
5.6025 6.3845 5.2633 4.9625 8.3283 5.9271 7.0000 9.8793 5.3528 6.1343 3.8785 4.8416 4.4213 1.2927 3.4573 4.8499 7.0877 5.2579 5.4983 6.3470 3.3788 5.6712 7.4797 4.5532 3.4808 2.9120 2.5824 5.0658 3.6394 4.2754 7.4287 6.7399 5.1724 1.2157 8.4659 7.0866 5.2254 4.8287 3.9447 5.9395 5.0278 9.0668 2.2379 3.7993 3.6150 2.7608 1.2742 2.0527 1.9122 1.9318 1.4943 1.7738 3.5775 1.8880 1.9340 2.4201 1.3836 3.5402 2.9963 1.7472 2.0126 2.7407 2.0997 2.7028 1.9618 2.5229 2.6730 3.1542 1.1608 2.9705 2.2536 5.1421 3.7937 2.0839 1.3479 2.1573 1.2873 1.3203 1.8175 1.7176 1.8746 2.6534 1.4975 2.0892 1.7807 1.9079 1.2776 3.4840 1.1245 1.1069 1.0488 1.0637 1.0898 2.3345 6.6573 5.2773 11.6130 11.4771 1.0841 1.0711 1.0506 1.0521 1.0847 1.0695 1.0914 1.1025 1.1029 1.0952 1.1058 1.0906 1.0922 1.0961 1.0947 1.0657
0.0019 0.0033 0.0048 0.0119 0.0386 0.0336 0.0499 0.1180 0.0881 0.1131 0.0940 0.1213 0.1502 0.0477 0.1407 0.2279 0.3923 0.3247 0.3647 0.4336 0.2427 0.5294 0.7673 0.4970 0.3936 0.3645 0.3610 0.7396 0.5919 0.7644 1.4164 1.3207 1.1268 0.2906 2.2166 1.9889 1.5707 1.6129 1.3368 2.0669 1.8337 3.6697 0.9349 1.6277 1.7122 1.4227 0.6790 1.1132 1.0493 1.1567 0.9345 1.1572 2.4363 1.3321 1.3971 1.7625 1.0200 2.7019 2.4526 1.4456 1.7029 2.3657 1.8539 2.4559 1.8647 2.4081 2.6036 3.0926 1.1737 3.1289 2.4262 5.6981 4.2869 2.3685 1.5752 2.6093 1.6048 1.6551 2.3257 2.2591 2.4777 3.6512 2.0683 2.9446 2.5277 2.7180 1.8505 5.1980 1.7446 1.7470 1.6701 1.6964 1.7526 3.8352 12.1728 10.0725 24.6497 25.8448 6.4131 6.4375 6.3315 6.3588 6.6613 6.6438 6.7810 6.9137 6.9409 6.9591 7.0740 7.4335 7.4546 7.5422 7.6037 9.9354
0.0530 0.0846 0.0057 0.2634 0.0738 0.4264 0.4213 1.6180 0.6740 0.5901 1.4457 1.9870 0.8972 0.5162 0.9362 1.4996 2.1884 3.9896 3.8339 0.9486 1.5282 10.5141 5.1965 15.0136 5.5297 0.2435 4.0032 37.7838 0.4296 15.2949 6.7636 8.3878 4.8651 167.2260 0.0282 4.8238 1.7715 13.6942 13.3512 19.9892 23.2693 22.7918 0.9608 55.4721 62.3130 63.6278 2.9639 22.4188 38.9879 5.5193 5.9042 5.0490 28.0104 2.3839 13.2220 26.6880 1.7604 62.9699 31.4397 3.3616 1.1857 23.3650 65.0456 12.7843 17.7660 36.7670 30.5519 34.0688 15.2943 43.9491 52.5395 176.1748 123.9145 136.7457 12.8899 85.8072 3.2329 1.8911 131.0961 87.0732 268.2052 26.5549 50.0126 94.6710 41.7829 42.4656 1.3228 482.0120 9.1813 4.1750 5.2583 4.1333 5.4355 17.9292 8.4015 102.6336 420.5448 43.6714 17.8370 9.2464 13.9759 64.2507 4.0347 23.2429 33.1439 55.1900 48.0057 16.2445 30.9570 1.0271 1.6173 2.3968 2.8393 217.4127
0.1831 1.4245 4.0890 3.6882 0.0919 0.2779 0.5145 0.8816 0.3065 1.2043 0.6268 0.6408 0.6493 0.1997 2.2564 1.4505 0.2954 1.2478 2.0780 1.1634 2.3393 3.5997 1.9312 1.9741 1.4751 0.9170 1.3487 0.6944 1.8446 0.7240 0.1544 1.4130 3.1014 3.1376 2.2813 6.7366 8.1659 1.0808 2.1889 9.4492 6.5672 4.7771 9.2605 3.0618 3.3466 1.4392 2.1784 4.8791 0.8121 4.6908 0.9202 3.7039 6.0158 7.6784 2.5108 2.6840 0.5580 9.1122 22.7777 7.3784 0.7211 1.6182 7.7948 18.9525 10.0885 22.3908 4.6700 2.1726 7.1010 8.7554 3.9895 1.0152 2.4703 18.4574 13.5053 3.8251 1.7743 2.8087 1.4898 19.4458 6.3387 1.9145 9.5598 3.3790 6.1887 3.2284 0.9599 11.6339 11.1748 1.6705 12.8086 21.2089 11.7119 2.9711 2.7990 155.2791 73.3660 170.5813 65.3827 75.6483 71.8448 85.3268 75.8738 110.9705 45.9448 77.1509 103.0717 72.9843 53.0055 40.2154 56.2242 106.1741 94.9359 45.6309
0.7367 0.7189 0.7251 0.7415 0.6511 0.7173 0.7232 0.5504 0.5767 0.0886 0.2834 0.1497 0.7448 0.6095 0.7455 0.5966 0.6240 0.5877 0.1822 0.6970 0.4792 0.4317 0.7317 0.1352 0.3811 0.3959 0.0584 0.5739 0.4377 0.1704 0.6380 0.1041 0.5610 0.6563 0.5674 0.6578 0.1639 0.6858 0.5764 0.1037 0.1094 0.0852 0.1799 0.3889 0.2822 0.7032 0.7159 0.0983 0.7428 0.7342 0.7282 0.7335 0.4632 0.6128 0.4233 0.5753 0.3307 0.1912 0.1192 0.6248 0.3538 0.6595 0.1950 0.2445 0.2117 0.2141 0.6785 0.4002 0.1423 0.6065 0.2746 0.7494 0.6512 0.4514 0.7446 0.7257 0.6758 0.7477 0.2711 0.5727 0.3646 0.6380 0.7482 0.4526 0.5865 0.4026 0.7337 0.1891 0.7450 0.7444 0.7251 0.7498 0.7352 0.2049 0.2581 0.4648 0.1941 0.3103 0.4543 0.2248 0.0640 0.0408 0.2844 0.0325 0.6822 0.5333 0.7418 0.4436 0.6215 0.5821 0.5538 0.1738 0.1871 0.1974
0.8484 0.8365 0.8406 0.8516 0.7887 0.8354 0.8394 0.7101 0.7315 0.1627 0.4416 0.2604 0.8538 0.7574 0.8542 0.7474 0.7685 0.7403 0.3083 0.8215 0.6479 0.6031 0.8450 0.2382 0.5518 0.5673 0.1104 0.7293 0.6089 0.2912 0.7790 0.1886 0.7188 0.7925 0.7240 0.7936 0.2816 0.8136 0.7313 0.1879 0.1973 0.1570 0.3049 0.5600 0.4401 0.8257 0.8344 0.1790 0.8524 0.8467 0.8427 0.8463 0.6331 0.7599 0.5949 0.7304 0.4971 0.3210 0.2130 0.7691 0.5227 0.7948 0.3264 0.3929 0.3494 0.3527 0.8084 0.5716 0.2491 0.7551 0.4309 0.8567 0.7888 0.6220 0.8536 0.8410 0.8065 0.8557 0.4266 0.7283 0.5344 0.7790 0.8559 0.6231 0.7393 0.5740 0.8464 0.3181 0.8539 0.8535 0.8406 0.8570 0.8474 0.3401 0.4103 0.6346 0.3251 0.4736 0.6247 0.3671 0.1204 0.0784 0.4428 0.0629 0.8111 0.6956 0.8518 0.6145 0.7666 0.7359 0.7128 0.2961 0.3152 0.3297
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
6 6 1 6 6 6 7 7 6 6 1 6 6 9 9 9 8 6 8 6 6 6 6 6 6 35 1 1 1 1 1 1 1 1 1 1 1 1 1 1
12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 14.00307 14.00307 12.00000 12.00000 1.00783 12.00000 12.00000 18.99840 18.99840 18.99840 15.99491 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 78.91834 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
4524.1898 21672.1094 24365.2409
0.99945 0.03323 0.00136 -0.03325 0.99927 0.01886 -0.00073 -0.01890 0.99982
1
0.01914 0.00400 0.00355
0.39891 0.08327 0.07407
34.61 42.83 56.87 91.82 127.59 141.09 158.20 204.84 240.50 254.54 291.80 296.75 345.44 359.88 378.12 406.33 440.99 465.78 482.77 489.94 502.40 572.68 600.36 619.25 630.28 663.14 700.83 716.19 755.93 792.58 818.47 829.73 874.88 916.35 959.14 993.01 1027.67 1083.32 1091.17 1105.73 1132.00 1192.50 1211.55 1226.90 1290.02 1345.56 1368.30 1380.37 1388.52 1450.45 1482.29 1513.95 1546.84 1574.51 1593.11 1599.64 1609.45 1637.52 1695.87 1705.01 1724.20 1741.49 1761.31 1786.75 1827.45 1831.26 1849.95 1856.04 1884.83 1923.76 1944.90 1973.17 1992.55 1998.30 2026.36 2061.43 2092.87 2098.70 2120.38 2149.66 2154.97 2198.81 2202.90 2225.31 2233.25 2237.25 2255.89 2289.54 2334.72 2354.85 2365.42 2367.17 2376.98 2402.50 2534.63 2589.60 2730.88 2812.80 4558.95 4595.28 4601.46 4608.11 4644.99 4671.79 4672.13 4693.88 4702.32 4724.89 4740.81 4893.57 4897.08 4917.01 4940.15 5723.24
0.329992
0.349845
0.350789
0.279551
-3741.720784
-3741.700931
-3741.699986
-3741.771225
2.389368D-04
MUNgauss
RevisionA2.1
retrievium
09-May-2021
DUDE C[C@@H]1CCC2=NN([C@@]([C@@H]2C1)(C(F)(F)F)O)C(=O)c3ccc(cc3)Br C20034159
RHF
6-31G(d)
(6D,10F)
C1
404.034724
|X|Y|Z|
45.156497 24.551759 101.894639
48.341271
16
|36.858105|
|12.457798|36.858105|
|8.926017|17.473817|0.500000|
|7.529623|12.398779|0.247152|36.858105|
|4.880339|7.469120|0.191987|12.404119|36.858105|
|4.390526|6.603745|0.167506|7.662724|12.737289|36.858105|
|3.455497|4.640960|0.120113|5.316409|7.821335|15.195861|53.358707|
|3.173657|4.089452|0.106837|4.205550|5.284097|8.853402|18.631571|53.358707|
|3.657173|4.780807|0.124472|4.385288|5.007468|8.056594|10.888928|17.602323|36.858105|
|4.907714|7.549488|0.193807|6.421278|7.320620|12.664095|11.119238|11.075848|12.307463|36.858105|
|4.560355|6.797199|0.205998|5.558164|6.445136|9.028018|8.851666|8.887101|9.035037|17.541002|0.500000|
|7.550252|12.386419|0.246620|7.537420|6.323541|7.564933|7.337383|7.097985|7.063930|12.388704|0.247625|36.858105|
|3.528723|4.233252|0.105253|3.855879|4.009867|5.573648|7.660301|10.650314|12.405958|7.340509|0.157230|6.302040|36.858105|
|2.839962|3.280261|0.084060|3.083086|3.261452|4.306250|6.362426|9.072762|8.064414|5.086788|0.120418|4.397514|14.468909|97.533100|
|3.781948|4.311908|0.107605|3.649174|3.568613|4.571079|5.838902|7.193744|8.082326|6.374602|0.147538|6.588561|14.436957|20.169009|97.533100|
|3.713201|4.371421|0.103469|4.221149|4.250966|5.684394|7.855473|9.413804|8.059770|6.445466|0.133648|6.201116|14.381537|20.128232|20.058623|97.533100|
|3.197247|4.002082|0.111014|3.561883|4.003869|5.614769|7.592569|10.829062|13.868301|7.989421|0.228345|5.434332|8.042305|15.502513|15.494139|12.135321|73.516695|
|2.587201|3.169941|0.084799|3.261576|3.981023|5.590614|10.789038|18.987704|7.612847|5.251649|0.131638|3.826756|5.902777|13.910379|9.655024|11.710675|11.674381|36.858105|
|2.391166|2.859384|0.077472|2.834959|3.312787|4.421108|7.454845|11.618187|6.816350|4.574863|0.119934|3.477465|5.701115|15.086158|9.757934|10.474266|12.629938|15.785482|73.516695|
|2.297337|2.756216|0.073857|2.960265|3.649098|4.655440|9.036779|10.470664|4.930365|4.015076|0.102574|3.134844|4.212953|9.901579|7.390852|9.222243|7.763603|12.724197|14.430886|36.858105|
|1.998973|2.350581|0.064176|2.486938|2.998272|3.614295|6.331871|7.094784|3.870009|3.251125|0.086731|2.618042|3.375822|8.124158|6.238695|7.233818|6.620939|7.756283|12.135278|13.708832|36.858105|
|1.803397|2.084101|0.056891|2.235001|2.656945|3.042566|5.131605|5.348711|3.072322|2.707215|0.072427|2.261778|2.770665|6.593843|5.265618|6.119286|5.228730|5.085646|8.164720|7.906632|13.777487|36.858105|
|1.815029|2.085735|0.056292|2.288734|2.713245|3.030718|5.118668|5.057643|2.898065|2.622331|0.068957|2.233203|2.666239|6.233379|5.069928|6.110058|4.766042|4.477312|6.885301|6.898624|7.998072|13.779304|36.858105|
|2.024001|2.345607|0.062266|2.631506|3.151484|3.550700|6.223204|5.906373|3.258110|2.964030|0.075830|2.520217|3.016947|6.922316|5.619384|7.156145|5.124036|5.008137|7.208642|7.920741|6.876867|7.903340|13.776754|36.858105|
|2.313686|2.748533|0.072286|3.074894|3.778096|4.577081|8.852027|8.576151|4.261371|3.729236|0.092879|3.045030|3.846139|8.740764|6.844368|9.128635|6.414304|7.477700|9.509646|13.710863|7.939020|6.856853|7.980719|13.771194|36.858105|
|1.569440|1.763784|0.047803|1.932657|2.226834|2.382724|3.805639|3.706458|2.253712|2.099306|0.055831|1.848903|2.117934|4.924868|4.157314|4.884564|3.764663|3.097195|4.999950|4.089910|4.608709|6.701815|10.045353|6.703234|4.605623|2539.412838|
|17.533367|8.776494|0.173581|6.811675|4.496244|4.150456|4.592703|4.246312|3.543948|4.514939|0.111523|6.826357|3.596970|6.525538|8.657213|8.924902|5.394201|2.554048|4.185262|2.283994|1.975198|1.790073|1.817735|2.044682|2.334376|53.604587|0.500000|
|17.551607|8.773656|0.213363|5.473941|4.043079|3.854603|4.242933|4.048051|3.526767|4.560868|0.122194|6.896914|3.453004|6.310911|8.724626|7.878560|5.688867|2.463073|4.133275|2.164689|1.905424|1.714330|1.708273|1.882756|2.145724|50.415068|0.301555|0.500000|
|17.549704|8.777289|0.213661|6.869195|4.544107|3.859594|4.225238|3.819624|3.119962|4.066156|0.108538|5.482041|2.971956|5.548787|7.019995|7.024368|4.949438|2.337948|3.840867|2.120933|1.867397|1.705090|1.724055|1.912383|2.151307|51.366323|0.301500|0.301669|0.500000|
|6.879847|8.845592|0.174143|17.506872|8.829575|6.752272|7.002392|5.635147|4.237709|5.689295|0.130260|6.881527|3.975998|7.155964|8.373710|10.474269|5.976869|3.230217|4.970673|2.964581|2.463359|2.228439|2.315445|2.707559|3.164738|66.658163|0.204019|0.140436|0.169756|0.500000|
|6.964832|8.805750|0.212697|17.549557|8.850870|5.576622|5.791984|4.692674|3.536724|4.810632|0.124223|5.488902|3.163390|5.900717|6.855195|7.685871|5.353966|2.800523|4.391980|2.610134|2.246249|2.055958|2.115545|2.402663|2.725552|62.114259|0.171289|0.141653|0.208910|0.303359|0.500000|
|4.046955|5.449400|0.140004|8.717344|17.596538|8.967348|10.022881|6.587525|4.266944|5.456963|0.134844|4.822292|3.569642|6.781710|7.052286|8.756432|6.158902|3.836824|5.595325|3.741738|3.067186|2.783575|2.925340|3.474482|4.086510|82.011651|0.108098|0.094345|0.108041|0.214947|0.207645|0.500000|
|4.506601|6.668295|0.201343|8.843265|17.500891|9.053872|8.605496|6.313730|4.493933|6.418344|0.181403|5.452951|3.532216|6.630102|7.259393|8.040168|6.863907|3.670430|5.571875|3.381692|2.880782|2.564408|2.576135|2.901355|3.393045|72.847812|0.110544|0.107262|0.121013|0.173792|0.217797|0.302277|0.500000|
|6.960952|8.796411|0.212778|5.489939|4.764324|5.532289|5.897075|6.076193|6.283231|8.826415|0.219359|17.587128|5.948307|9.658374|16.251367|12.112600|9.727141|3.464513|5.849686|2.825526|2.420702|2.095123|2.044861|2.264916|2.694235|58.221874|0.170818|0.209143|0.141691|0.140917|0.123066|0.106162|0.122498|0.500000|
|6.941943|8.884162|0.174486|6.884808|5.613611|6.652222|7.060526|6.920015|6.520535|8.762324|0.173985|17.589359|6.931231|10.610949|16.111984|17.875697|8.561662|3.771622|6.056870|3.132115|2.585495|2.249932|2.251684|2.577935|3.121025|63.527923|0.205962|0.171472|0.141231|0.206345|0.141255|0.127878|0.128417|0.303496|0.500000|
|2.777490|3.372029|0.093031|3.110050|3.516248|4.781110|6.976206|10.428910|9.988085|5.956826|0.165495|4.359916|7.218200|16.713298|13.348295|11.222163|35.437184|7.575775|17.403722|4.796716|4.176161|3.205357|2.850203|3.015259|3.779911|75.682685|0.074327|0.076981|0.068251|0.082990|0.074330|0.087538|0.094150|0.120839|0.112586|0.500000|
|1.946129|2.281266|0.062998|2.357556|2.806622|3.391348|5.701204|6.660452|3.853322|3.185842|0.087059|2.558979|3.330434|8.143211|6.258090|6.882601|6.993108|7.282114|13.488034|8.938754|17.756917|8.935519|5.674251|4.957442|5.654889|130.316973|0.053046|0.052107|0.050426|0.064201|0.059286|0.077934|0.076189|0.066885|0.069356|0.126630|0.500000|
|1.653846|1.891411|0.052035|2.007626|2.352187|2.646535|4.307719|4.499104|2.700491|2.404987|0.065308|2.037619|2.454323|5.861182|4.765184|5.371685|4.715057|4.146123|7.041248|5.629971|8.906251|17.759393|8.918246|5.635346|4.946901|219.980410|0.045469|0.043956|0.043657|0.055334|0.051816|0.067939|0.063947|0.053050|0.056039|0.080365|0.214601|0.500000|
|1.985224|2.270397|0.059833|2.585101|3.036456|3.294429|5.551468|5.108727|2.930450|2.741827|0.069829|2.399147|2.773749|6.281893|5.250618|6.746830|4.579695|4.071031|6.010732|5.637406|4.957389|5.636947|8.923130|17.759133|8.913534|220.244750|0.056175|0.050995|0.052460|0.074971|0.066294|0.094952|0.077024|0.059744|0.068892|0.073736|0.107659|0.124153|0.500000|
|2.565832|3.068079|0.078785|3.516716|4.306177|5.270474|10.406037|9.291547|4.609783|4.130261|0.098920|3.416297|4.262041|9.300069|7.458054|10.775888|6.555925|6.838093|8.704558|8.896460|5.645091|4.949242|5.678862|8.972939|17.789245|130.567595|0.072816|0.065215|0.065773|0.103401|0.085005|0.131501|0.102656|0.082010|0.099673|0.104165|0.124247|0.107517|0.216008|0.500000|
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