RDKit 3D 123127 0 0 0 0 0 0 0 0999 V2000 -9.2543 -3.0090 -0.6061 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2292 -2.4432 -1.4901 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2263 -2.7754 -2.7019 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2597 -1.5580 -1.0577 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2997 -1.0445 -1.9457 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3423 -0.1060 -1.2934 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6436 -0.7415 -0.2677 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 0.0188 0.0723 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6309 -0.6896 0.8222 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4567 -0.9046 0.1172 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3211 -0.1977 0.8313 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0176 -0.7601 0.3974 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8056 -1.4361 -0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2829 -0.9317 -1.9925 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0433 0.3111 -2.0063 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8629 0.5693 -0.7455 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1733 0.1571 0.4927 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6480 1.4072 1.2505 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 -0.4262 1.5251 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7654 -1.3286 2.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 0.2092 1.5339 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0736 -0.2858 0.2349 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8312 -1.7959 0.2532 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4771 0.0972 0.0150 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5089 -0.0281 1.0503 C 0 0 2 0 0 0 0 0 0 0 0 0 7.3958 0.8399 2.2741 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6831 0.5428 0.4158 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9509 -1.3986 1.3741 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2562 -1.9499 0.9549 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2352 -2.1306 2.0107 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3730 1.4591 -0.5905 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3707 2.5378 0.2692 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3123 3.5445 0.1261 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3326 4.7171 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1833 3.4896 -0.7905 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1131 1.4579 -1.3767 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3027 0.2257 -0.9420 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4703 -0.7508 -2.0883 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0144 -2.7102 -0.8445 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3756 -3.0635 -2.2699 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7452 -3.8469 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2514 -2.3848 -0.0175 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3633 -2.9062 -0.7212 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2012 -3.8719 -0.1941 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3379 -4.3533 -1.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9441 -4.2922 0.9676 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8702 1.3441 0.6544 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.2099 1.3523 2.0024 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5378 2.0284 2.9917 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9010 2.0348 4.4218 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5357 2.6898 2.6329 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9055 2.0554 -0.2153 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4751 3.1559 0.4244 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3495 4.4592 -0.0357 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9421 5.6349 0.6228 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6758 4.6186 -1.0933 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9615 1.1366 -0.7429 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.0280 0.9010 0.1442 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3344 1.2834 -0.1111 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4180 1.0063 0.8661 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5617 1.8751 -1.2067 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5179 -4.0300 -0.9553 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9467 -2.9896 0.4563 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1753 -2.4040 -0.7265 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7722 -0.5027 -2.8013 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7242 -1.8736 -2.4012 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6027 0.2084 -2.0623 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0368 0.2342 -0.9267 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4998 -0.4499 -0.9114 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4664 -0.3456 1.9178 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4633 0.8673 0.6215 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1793 -1.6189 1.1258 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -1.4670 -2.9386 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6839 0.3302 -2.9108 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2963 1.1379 -2.1976 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8614 1.7141 -0.7304 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4504 2.0059 1.6728 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9598 1.1401 2.0418 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0399 0.4633 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9793 -0.2250 2.4045 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3363 1.2954 1.5537 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6569 -2.1807 1.2771 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6473 -2.3655 -0.2066 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8985 -2.0407 -0.2987 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8415 -0.5717 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3831 1.2997 2.5824 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2265 0.1087 3.1288 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5757 1.5338 2.3214 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6834 0.3146 -0.5348 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1688 -3.0426 0.7795 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0476 -1.8256 1.7359 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6664 -1.4248 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2132 1.5815 -1.3331 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3714 4.8849 1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5896 5.6239 0.4752 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1672 4.5570 1.7788 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2507 1.5054 -2.4612 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 2.3381 -1.1175 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6988 -0.2061 -3.0571 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3885 -1.3997 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6493 -1.4605 -2.2105 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7995 -2.2264 -2.8268 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4927 -3.5375 -2.7497 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1593 -3.8642 -2.1972 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5692 -3.8596 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3455 -4.8102 -0.6457 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8141 -3.7277 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1776 -2.8575 0.9637 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2212 -3.7139 -0.9449 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5672 -5.4275 -0.7532 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0238 -4.3961 -2.0875 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9469 1.9915 0.5668 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 1.5218 5.0647 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0106 3.0894 4.7903 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8618 1.5385 4.6404 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3633 2.4585 -1.1219 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1813 6.4502 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8414 6.0085 0.1019 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1733 5.4545 1.6824 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4156 1.6705 -1.6311 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1859 1.8323 0.8441 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9381 0.0564 0.6626 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0223 1.0121 1.9159 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 37 1 0 37 38 1 6 37 36 1 0 36 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 33 35 2 0 31 24 1 0 24 25 1 0 25 26 1 0 25 27 1 6 25 28 1 0 28 29 1 0 28 30 2 0 24 22 1 0 22 23 1 1 22 21 1 0 21 19 1 0 19 20 2 0 19 17 1 0 17 18 1 1 13 39 1 0 39 40 1 0 39 41 1 0 39 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 44 46 2 0 8 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 49 51 2 0 47 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 54 56 2 0 52 57 1 0 57 58 1 0 58 59 1 0 59 60 1 0 59 61 2 0 57 6 1 0 42 10 1 0 17 12 1 0 17 16 1 0 22 37 1 0 1 62 1 0 1 63 1 0 1 64 1 0 5 65 1 0 5 66 1 0 6 67 1 6 8 68 1 6 10 69 1 6 11 70 1 0 11 71 1 0 12 72 1 1 14 73 1 0 15 74 1 0 15 75 1 0 16 76 1 1 38 99 1 0 38100 1 0 38101 1 0 36 97 1 0 36 98 1 0 31 93 1 6 34 94 1 0 34 95 1 0 34 96 1 0 24 85 1 6 26 86 1 0 26 87 1 0 26 88 1 0 27 89 1 0 29 90 1 0 29 91 1 0 29 92 1 0 23 82 1 0 23 83 1 0 23 84 1 0 21 80 1 0 21 81 1 0 18 77 1 0 18 78 1 0 18 79 1 0 40102 1 0 40103 1 0 40104 1 0 41105 1 0 41106 1 0 41107 1 0 42108 1 1 45109 1 0 45110 1 0 45111 1 0 47112 1 1 50113 1 0 50114 1 0 50115 1 0 52116 1 6 55117 1 0 55118 1 0 55119 1 0 57120 1 6 60121 1 0 60122 1 0 60123 1 0 M END