RDKit 3D 100104 0 0 0 0 0 0 0 0999 V2000 -5.5169 5.4712 0.3935 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5316 4.9219 -0.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9201 3.6408 -0.8908 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7162 3.8113 -1.7755 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6116 4.4253 -1.4289 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0106 4.4264 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0649 3.3949 0.7196 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 2.0311 0.2491 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9233 1.6764 -0.5024 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4432 2.1525 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3019 1.1734 0.5781 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4542 0.8345 -0.1926 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4595 1.7613 -0.3746 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2809 2.9038 0.1296 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6928 1.4411 -1.1437 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 0.4779 -0.6197 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8689 -0.3995 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0961 -0.9257 1.1224 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2239 -0.9877 -0.0567 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0216 -0.5636 -1.0227 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3570 -1.2096 -1.1032 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0017 -0.9832 0.2791 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1765 -1.6718 1.3204 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7701 -2.0204 0.8489 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3050 2.6204 -1.8824 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5462 1.5708 -2.6517 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4849 0.1536 1.1556 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2651 0.4346 2.6372 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -1.3185 1.0844 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5434 -1.7340 0.0224 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3711 -2.1349 1.4555 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5227 -2.7347 2.8494 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3043 -2.3014 0.5522 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0711 -2.5962 -0.8592 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2811 -2.6340 -1.7277 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5750 -2.1274 -1.1921 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1417 -0.8359 -1.2253 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4891 0.2343 -1.8757 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3703 -0.6730 -0.6023 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9742 -1.7803 0.0056 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4677 -3.0469 0.0566 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2513 -3.1608 -0.5605 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3624 -4.7518 -0.4747 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6237 -5.9478 -0.0121 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8454 -5.3397 0.5585 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7455 -6.2435 1.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1884 -4.1289 0.5809 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1984 0.4663 -0.3824 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3880 1.6510 -0.4613 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2087 2.3266 0.5134 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8959 2.6624 -1.4732 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0681 4.8185 1.0877 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4739 5.6681 0.7761 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0425 6.4483 0.4153 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6052 3.4399 0.1351 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8211 3.3677 -2.7863 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0974 4.9982 -2.2232 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4786 5.3224 0.2637 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2227 3.6259 1.7864 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7227 1.2794 0.5313 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1302 0.9520 -1.3126 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9311 2.1669 -1.3375 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4233 3.1530 0.0578 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6832 1.9945 1.2757 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1357 -0.6491 1.2965 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7017 0.1983 -1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2522 -2.2944 -1.2408 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9800 -0.7211 -1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0418 -1.3414 0.2133 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0696 0.1173 0.4348 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7376 -2.6115 1.5937 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1418 -1.0261 2.2364 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1484 -2.0972 1.7685 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8310 -3.0301 0.4007 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4154 2.6840 -1.9903 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8301 3.6283 -1.8152 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1712 0.8957 -3.2388 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5331 1.7556 -3.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5012 0.1798 0.6092 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7105 0.0420 2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0408 -0.0438 3.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2933 1.5113 2.8621 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5307 -1.4637 1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2066 -2.4328 0.2633 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2834 -2.3717 3.5136 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4309 -3.8331 2.7734 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5318 -2.4414 3.2219 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3436 -2.1916 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2747 -2.0100 -1.3652 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -3.6635 -0.8443 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4263 -3.7665 -1.9821 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9549 -2.2469 -2.7115 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3543 1.0370 -2.1944 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9801 -1.6920 0.5194 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9393 -6.4427 -0.9691 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1722 -6.6761 0.6803 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5405 -6.5827 0.5954 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7809 2.5560 1.4023 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4320 2.1650 -2.3214 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8050 3.2117 -1.8768 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 51 1 0 51 49 1 0 49 50 1 0 49 48 2 0 48 39 1 0 39 40 2 0 40 41 1 0 41 42 2 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 45 47 2 0 42 36 1 0 36 35 1 0 35 34 1 0 34 33 1 0 33 31 2 0 31 32 1 0 31 29 1 0 29 30 1 0 29 27 1 0 27 28 1 0 27 11 1 0 11 10 1 0 10 9 1 0 9 8 2 0 8 7 1 0 7 6 2 0 6 5 1 0 5 4 2 0 11 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 15 25 1 0 25 26 1 0 15 16 1 0 16 17 2 0 17 18 1 0 17 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 36 37 2 0 37 38 1 0 4 3 1 0 26 15 1 0 24 19 1 0 37 39 1 0 47 41 1 0 1 52 1 0 1 53 1 0 1 54 1 0 3 55 1 1 51 99 1 0 51100 1 0 50 98 1 0 40 94 1 0 44 95 1 0 44 96 1 0 46 97 1 0 35 91 1 0 35 92 1 0 34 89 1 0 34 90 1 0 33 88 1 0 32 85 1 0 32 86 1 0 32 87 1 0 29 83 1 1 30 84 1 0 27 79 1 6 28 80 1 0 28 81 1 0 28 82 1 0 11 64 1 1 10 62 1 0 10 63 1 0 9 61 1 0 8 60 1 0 7 59 1 0 6 58 1 0 5 57 1 0 4 56 1 0 25 75 1 0 25 76 1 0 26 77 1 0 26 78 1 0 18 65 1 0 20 66 1 0 21 67 1 0 21 68 1 0 22 69 1 0 22 70 1 0 23 71 1 0 23 72 1 0 24 73 1 0 24 74 1 0 38 93 1 0 M END