RDKit 3D 102108 0 0 0 0 0 0 0 0999 V2000 -4.4378 2.5707 3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8519 1.1682 3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8321 0.3265 4.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2069 0.9847 2.4459 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2086 0.2702 1.1202 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3008 0.9597 0.1305 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.9202 2.3304 -0.0385 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2486 3.3471 0.2034 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2282 2.4688 -0.4598 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9571 1.1686 0.7932 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8869 0.4436 2.0594 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9517 0.9221 -0.2529 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2505 1.9658 -0.6068 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2225 1.8904 -1.7136 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 0.5498 -1.4816 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7413 0.5305 -2.1267 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7796 1.0513 -3.5101 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6121 1.4932 -1.2969 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0864 1.2058 -1.4599 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4900 1.0793 -2.8085 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3081 -0.2248 -3.2478 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5423 -0.6560 -4.4054 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7856 -0.9723 -2.0583 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1738 -2.4171 -2.1038 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6874 -3.0697 -1.0026 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4354 -0.1826 -0.9490 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6846 -0.4069 -0.6164 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0865 -0.6516 0.6680 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8672 0.4215 1.0441 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7691 0.3274 2.0243 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1670 0.8079 1.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0813 0.6991 2.6305 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9376 -0.9137 2.8038 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8612 -0.7398 4.1993 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0587 -2.0693 2.3587 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5334 -3.3040 2.7158 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9371 -1.8835 0.8466 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5310 -2.9998 0.1916 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3152 -0.8239 -1.8813 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4353 -1.8209 -2.5391 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8475 -1.8351 -1.6846 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6021 -0.5046 -1.8136 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0563 -0.5232 -3.2481 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7794 -0.4038 -0.9145 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6332 -1.4868 0.1607 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1399 -0.6349 -1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1912 0.3512 -1.1951 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.4300 -0.2488 -1.5033 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3926 2.7887 3.0042 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1638 3.3239 2.9371 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4477 2.7171 4.4343 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3757 -0.6164 4.0747 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4875 0.8442 5.0568 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8097 0.1354 4.6852 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6685 1.9869 2.3189 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9180 0.4248 3.1103 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1066 -0.8158 1.1697 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2537 0.4355 0.7082 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4884 2.7595 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9204 2.2645 1.1083 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9155 0.5050 2.5933 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3486 -0.5587 2.1268 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3646 2.9212 -0.1382 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5521 2.7394 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 1.9410 -2.6319 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 0.4292 -0.3778 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5257 1.8907 -3.6767 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1726 1.6403 -3.6903 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9985 0.3359 -4.2988 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4703 2.5432 -1.6919 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 1.4188 -0.2348 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6269 2.0068 -0.9404 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -2.5609 -2.1703 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7645 -2.8148 -3.0672 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6806 -2.4280 -0.2442 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7912 -0.2743 -0.0227 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2575 -0.6588 1.4071 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4824 1.1282 2.7977 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5514 0.1788 0.7519 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1468 1.8454 1.2611 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9008 0.2080 2.3711 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9858 -1.2965 2.6482 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6527 0.1919 4.4507 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0622 -1.8929 2.8163 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0557 -3.5919 3.5309 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0026 -1.6899 0.5189 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8908 -3.5060 0.7757 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1644 -0.9906 -0.7624 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2676 -1.7402 -3.5972 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8493 -2.8545 -2.3732 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -1.9569 -0.6632 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -2.6898 -2.0906 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4957 -1.5284 -3.4568 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7067 0.3239 -3.5264 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 -0.4679 -3.9896 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1061 -1.1334 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6603 -1.8915 0.4376 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2306 -2.4467 -0.2791 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1452 -0.7348 -2.6277 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5441 -1.6472 -1.2078 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1206 1.1851 -1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1700 0.3896 -1.5297 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 47 1 0 47 48 1 0 47 46 1 0 46 44 1 0 44 45 1 1 44 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 6 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 6 24 25 1 0 23 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 30 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 35 37 1 0 37 38 1 0 23 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 6 12 10 1 0 10 11 1 0 6 7 1 6 7 9 1 0 7 8 2 0 11 2 1 0 10 6 1 0 42 44 1 0 42 15 1 0 39 16 1 0 26 19 1 0 37 28 1 0 1 49 1 0 1 50 1 0 1 51 1 0 3 52 1 0 3 53 1 0 3 54 1 0 4 55 1 0 4 56 1 0 5 57 1 0 5 58 1 0 47101 1 6 48102 1 0 46 99 1 0 46100 1 0 45 96 1 0 45 97 1 0 45 98 1 0 13 63 1 0 14 64 1 0 14 65 1 0 15 66 1 1 17 67 1 0 17 68 1 0 17 69 1 0 18 70 1 0 18 71 1 0 19 72 1 1 24 73 1 0 24 74 1 0 25 75 1 0 26 76 1 1 28 77 1 1 30 78 1 1 31 79 1 0 31 80 1 0 32 81 1 0 33 82 1 1 34 83 1 0 35 84 1 1 36 85 1 0 37 86 1 6 38 87 1 0 39 88 1 1 40 89 1 0 40 90 1 0 41 91 1 0 41 92 1 0 43 93 1 0 43 94 1 0 43 95 1 0 10 60 1 1 11 61 1 0 11 62 1 0 9 59 1 0 M END