RDKit 3D 122127 0 0 0 0 0 0 0 0999 V2000 -2.3724 0.5999 3.3086 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8062 -0.1175 2.3461 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 0.1253 2.1416 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5409 -1.0184 2.3393 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0189 -0.9260 2.2226 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5211 -2.3502 2.5158 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5911 -0.3653 0.9643 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2171 1.0837 0.7125 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5824 1.8419 0.7244 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9542 2.1453 2.0062 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3787 0.8205 0.0313 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7751 1.1123 -0.2724 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6085 1.4449 0.7817 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7730 2.3359 -1.2257 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2561 2.6421 -1.4258 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3102 3.7544 -2.2648 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8859 1.4995 -2.1448 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3449 1.8359 -2.3929 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9704 0.7221 -3.1635 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1275 0.2165 -2.5485 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0246 -0.3609 -3.5568 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1567 -0.8915 -2.4673 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7346 0.1638 -1.4573 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6110 0.1566 -0.2248 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2945 -0.0175 -1.1337 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9473 -1.3649 -0.6147 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 -1.5090 -0.2883 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0675 -0.4730 0.7629 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8801 -0.7454 1.9657 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6622 -1.0185 1.5602 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2391 -2.4435 1.7324 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1281 -0.8990 1.9761 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8649 -1.7584 1.1236 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2149 -1.7084 1.4486 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.5582 -2.9941 1.9324 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1759 -3.9192 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0002 -3.8379 -0.2698 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.4064 -4.6332 -1.2444 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0363 -2.4294 -0.7519 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.0067 -2.2413 -1.7395 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3530 -1.8442 -3.2246 S 0 0 2 0 0 6 0 0 0 0 0 0 -6.6538 -2.9768 -3.8897 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3169 -0.7544 -2.9839 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4767 -1.2280 -4.2764 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1331 -1.3818 0.3281 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.8750 -0.1598 -0.3018 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9393 0.6947 -0.2761 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.5290 0.8735 -1.5458 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7042 1.6150 -1.4241 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5272 2.9677 -0.8242 C 0 0 1 0 0 0 0 0 0 0 0 0 -10.8292 3.4839 -0.6175 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8984 2.8443 0.5482 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.5801 4.0666 1.1126 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6367 2.0142 0.3564 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.8724 1.9742 1.4935 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6581 2.6754 1.2957 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4229 0.5105 3.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8255 1.2853 3.9398 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0811 0.9893 2.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 0.4370 1.0461 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2558 -1.9070 1.6634 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -1.4592 3.3566 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3642 -0.3373 3.1253 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8697 -2.8870 1.6532 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1966 -2.3769 3.4026 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -2.9967 2.8885 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1132 -0.9935 0.1199 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8839 1.1705 -0.3388 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5877 1.5537 1.4546 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4886 2.7674 0.1571 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5101 2.9759 2.3062 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8667 0.6880 -0.9817 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3466 2.3234 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2655 3.1784 -0.7404 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2990 1.9793 -2.1591 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6818 2.8604 -0.4481 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8842 4.4583 -1.9089 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3971 1.4213 -3.1507 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8638 2.0154 -1.4276 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3562 2.8177 -2.9172 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3480 1.1709 -4.1307 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2663 -0.6943 -2.9542 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4322 -0.0570 -4.4408 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6537 -1.2257 -3.9217 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6722 -1.7472 -1.9651 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2436 -1.3314 -2.9689 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1036 -0.3422 0.6365 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8715 1.1664 0.1359 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5136 -0.4462 -0.4254 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7352 0.0916 -2.1134 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1376 -2.1009 -1.4407 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5661 -1.7154 0.2374 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9251 -1.2185 -1.2148 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3356 -2.5377 -0.0128 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4516 -0.4291 2.9159 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9286 -0.4017 1.8373 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0073 -1.8712 2.0277 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6828 -0.7238 0.4693 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7029 -2.6221 2.6835 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6852 -2.8645 0.8652 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1957 -3.0540 1.8681 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2896 -1.2211 3.0271 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 0.1055 1.8233 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3310 -0.9685 2.2912 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1122 -3.9248 0.7417 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3930 -4.9329 1.4454 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9881 -4.2917 -0.0572 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6322 -4.1988 -1.6533 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0493 -2.2408 -1.2711 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3444 -1.7127 -4.2392 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1754 -1.4096 0.7174 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7517 0.1966 0.3129 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2507 1.6603 -2.3768 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3560 1.0312 -0.7117 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0096 3.6930 -1.4723 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2136 3.1307 0.2291 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6051 2.3042 1.2061 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5891 4.8210 0.4928 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0505 2.5969 -0.4231 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0244 2.6606 2.1895 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1620 2.1376 0.4581 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8436 3.7003 0.9117 H 0 0 0 0 0 0 0 0 0 0 0 0 56 55 1 0 55 54 1 0 54 52 1 0 52 53 1 0 52 50 1 0 50 51 1 0 50 49 1 0 49 48 1 0 48 47 1 0 47 46 1 0 46 45 1 0 45 34 1 0 34 33 1 0 33 32 1 0 32 30 1 0 30 31 1 0 30 2 1 0 2 1 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 11 28 1 0 28 29 1 1 28 27 1 0 27 26 1 0 26 25 1 0 25 23 1 0 23 24 1 1 23 22 1 0 22 21 1 0 21 19 1 0 19 20 1 0 19 18 1 0 18 17 1 0 17 15 1 0 15 16 1 0 15 14 1 0 14 12 1 0 12 13 1 1 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 37 39 1 0 39 40 1 0 41 40 1 1 41 44 1 0 41 42 2 0 41 43 2 0 47 54 1 0 39 45 1 0 28 7 1 0 12 25 1 0 12 11 1 0 17 23 1 0 56120 1 0 56121 1 0 56122 1 0 54119 1 6 52117 1 1 53118 1 0 50115 1 6 51116 1 0 49113 1 0 49114 1 0 47112 1 1 45111 1 1 34104 1 1 32102 1 0 32103 1 0 30 98 1 6 31 99 1 0 31100 1 0 31101 1 0 1 57 1 0 1 58 1 0 3 59 1 0 3 60 1 0 4 61 1 0 4 62 1 0 5 63 1 1 6 64 1 0 6 65 1 0 6 66 1 0 7 67 1 6 8 68 1 0 8 69 1 0 9 70 1 6 10 71 1 0 11 72 1 6 29 95 1 0 29 96 1 0 29 97 1 0 27 93 1 0 27 94 1 0 26 91 1 0 26 92 1 0 25 90 1 6 24 87 1 0 24 88 1 0 24 89 1 0 22 85 1 0 22 86 1 0 21 83 1 0 21 84 1 0 19 81 1 6 20 82 1 0 18 79 1 0 18 80 1 0 17 78 1 6 15 76 1 1 16 77 1 0 14 74 1 0 14 75 1 0 13 73 1 0 36105 1 0 36106 1 0 37107 1 1 38108 1 0 39109 1 6 44110 1 0 M END