RDKit 3D 107109 0 0 0 0 0 0 0 0999 V2000 -3.4142 3.2738 1.1966 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7201 2.1782 0.3583 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9504 1.5653 0.4838 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7894 1.9787 1.3397 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2822 0.4187 -0.3930 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.4731 0.6839 -1.2954 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7180 0.9828 -0.5512 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0937 2.2621 -0.2163 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2424 2.5487 0.4796 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1106 1.5260 0.8928 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2513 1.8510 1.5924 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2403 1.0011 2.0661 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0212 0.2638 1.0643 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3591 0.4237 0.9872 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1719 -0.2983 -0.0035 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0090 1.3609 1.9413 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7236 0.2498 0.5516 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5579 -0.0361 -0.1541 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1165 0.0920 -1.1983 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2606 -0.7531 -0.7135 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4386 -1.3292 0.5238 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0875 -1.0560 -1.5753 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1752 -2.5627 -1.8662 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8487 -0.8444 -0.8787 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1218 0.1759 -0.9366 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4559 1.2946 -1.7348 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1479 0.2565 -0.1573 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4595 -0.9428 0.6638 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6243 -2.2187 -0.0231 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -3.1641 -0.0477 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7766 -4.3745 -0.7233 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9402 -4.6280 -1.3761 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0973 -5.8354 -2.0539 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9522 -3.6927 -1.3625 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7869 -2.5119 -0.6947 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 0.7170 -0.9452 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3746 1.0906 -0.8664 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0132 1.4652 -2.0963 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 1.2287 0.3396 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3570 0.3161 0.0823 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2742 -0.0953 0.8082 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4241 0.2939 2.1206 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2717 -1.0607 0.2404 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9350 -1.3531 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 -0.4670 0.2651 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2827 -0.5084 1.3358 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7558 -1.1297 2.4568 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6513 0.1027 1.3808 C 0 0 1 0 0 0 0 0 0 0 0 0 11.5406 -0.9312 1.6776 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9776 0.6039 -0.0102 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3136 1.2225 -0.0581 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4804 2.5524 0.1765 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7486 3.1200 0.1297 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8616 2.3596 -0.1531 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6807 0.9999 -0.3918 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4058 0.4436 -0.3418 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9256 3.1023 2.1712 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8066 4.2339 0.7712 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3108 3.3084 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5044 -0.4748 0.2451 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5575 -0.1582 -2.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1700 1.5680 -1.9285 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4200 3.0721 -0.5412 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5115 3.5650 0.7296 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8979 1.5627 2.7824 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7607 0.1960 2.7177 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5708 -0.4090 0.3757 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1179 0.2560 -0.1917 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4186 -1.2947 0.3904 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6908 -0.4025 -0.9983 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5654 2.3879 1.7886 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0999 1.3853 1.7517 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8479 1.0256 2.9953 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3422 -0.5860 0.8561 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2797 -1.0511 -0.4088 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 -0.9101 1.4119 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1278 -0.5441 -2.5461 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4315 -3.1334 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2225 -2.9560 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9755 -2.7695 -2.6144 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6544 1.1750 -2.7225 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9316 1.1036 0.5861 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6887 -1.0528 1.4881 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4052 -0.7690 1.2443 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3319 -3.0523 0.4759 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0353 -5.1139 -0.7283 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9491 -6.0244 -2.5347 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8575 -3.9562 -1.9027 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5813 -1.7969 -0.6933 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5693 0.7812 -2.5921 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7633 1.1219 1.2858 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6209 2.2954 0.2917 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0979 -0.2862 2.9105 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2531 -2.0368 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5057 -0.3949 -1.6139 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1957 -2.1471 -1.3295 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8717 -1.5386 -1.7473 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0490 -0.9088 3.4075 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7058 0.9137 2.1223 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1609 -1.4768 2.4267 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2456 1.3746 -0.3517 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9283 -0.2415 -0.7304 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6287 3.2048 0.4066 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8863 4.1749 0.3148 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8433 2.8055 -0.1884 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5247 0.3747 -0.6139 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3195 -0.6132 -0.5335 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 3 14 15 1 0 14 16 1 0 10 17 1 0 17 18 2 0 5 19 1 0 19 20 2 0 20 21 1 0 20 22 1 0 22 23 1 0 22 24 1 0 24 25 2 0 25 26 1 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 32 33 1 0 32 34 1 0 34 35 2 0 27 36 1 0 36 37 2 0 37 38 1 0 37 39 1 0 39 40 1 0 40 41 2 0 41 42 1 0 41 43 1 0 43 44 1 0 43 45 1 0 45 46 2 0 46 47 1 0 46 48 1 0 48 49 1 0 48 50 1 0 50 51 1 0 51 52 2 0 52 53 1 0 53 54 2 0 54 55 1 0 55 56 2 0 18 7 1 0 35 29 1 0 56 51 1 0 1 57 1 0 1 58 1 0 1 59 1 0 5 60 1 1 6 61 1 0 6 62 1 0 8 63 1 0 9 64 1 0 12 65 1 0 12 66 1 0 13 67 1 0 15 68 1 0 15 69 1 0 15 70 1 0 16 71 1 0 16 72 1 0 16 73 1 0 17 74 1 0 18 75 1 0 21 76 1 0 22 77 1 6 23 78 1 0 23 79 1 0 23 80 1 0 26 81 1 0 27 82 1 1 28 83 1 0 28 84 1 0 30 85 1 0 31 86 1 0 33 87 1 0 34 88 1 0 35 89 1 0 38 90 1 0 39 91 1 0 39 92 1 0 42 93 1 0 43 94 1 1 44 95 1 0 44 96 1 0 44 97 1 0 47 98 1 0 48 99 1 1 49100 1 0 50101 1 0 50102 1 0 52103 1 0 53104 1 0 54105 1 0 55106 1 0 56107 1 0 M END