RDKit 3D 110110 0 0 0 0 0 0 0 0999 V2000 11.4272 -0.7516 -1.6758 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9135 -0.6719 -0.2614 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8689 0.1967 0.5367 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5324 -0.0147 -0.3092 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0485 0.0579 1.1014 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6921 0.7168 1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6812 -0.0355 0.3828 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2725 0.5699 0.4071 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8676 0.5477 1.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2820 1.9984 -0.0251 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4234 -0.3223 -0.4066 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0156 -0.0088 -0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 0.1111 0.5164 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6808 0.4081 0.1213 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0764 0.5223 1.4399 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5842 -0.7480 1.9388 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2987 -1.6311 2.5553 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8058 -1.0797 1.8321 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -0.2577 1.2227 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8033 -1.1773 0.6127 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2771 -1.9622 -0.4425 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9443 -1.2464 0.9782 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9410 -0.8164 1.8322 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.5840 -0.8452 3.3089 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7680 -0.3684 4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3353 -2.2978 3.6619 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3277 0.5734 1.4814 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5549 1.4729 2.5474 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4761 1.0409 0.3231 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3450 0.4807 -0.9643 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.6451 0.6361 -1.7214 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8119 -0.0438 -1.0709 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5714 -1.5454 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2745 0.5823 0.2041 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3499 1.3269 -1.7556 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8742 2.6171 -1.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3140 0.8253 -2.0691 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0726 0.7713 -2.6481 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0878 0.9597 -4.1777 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0472 1.7046 -2.1414 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3555 2.8907 -1.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 1.4040 -2.2963 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 0.2507 -2.9128 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0483 0.5797 -3.6553 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0836 -0.8281 -1.9546 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3563 -1.9655 -2.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1052 -0.6303 -0.6004 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8637 -1.5497 -2.1908 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5205 -0.9630 -1.6951 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2408 0.2364 -2.1754 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8164 -1.6624 0.2122 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4765 1.2337 0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8652 0.1100 0.0688 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9232 -0.1611 1.5835 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8534 -0.6747 -0.8966 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5714 0.9683 -0.7909 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7529 0.5967 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8968 -0.9862 1.4744 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4849 0.9285 2.2089 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8668 1.7549 0.7041 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0060 -0.0174 -0.7021 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6512 -1.1023 0.6662 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4362 1.4911 2.2245 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1538 -0.2862 2.0785 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7437 0.2735 2.5409 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6334 2.1841 -1.0433 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8945 2.5640 0.7396 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2699 2.4049 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4548 -1.3928 0.0045 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9026 -0.4943 -1.4361 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8943 0.8801 -1.3708 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -0.8385 -1.3055 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4599 0.9613 1.1485 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1406 -0.8205 1.1126 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 1.3210 -0.4702 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6669 0.9789 2.1678 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8319 1.3282 1.3143 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7975 -1.4008 3.3885 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2284 0.5313 1.8429 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2772 0.2967 0.3828 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7011 -2.7503 -0.1334 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9025 -1.3971 1.7811 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7251 -0.2018 3.5639 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5923 0.5742 4.6654 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9576 -1.1357 4.9139 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6583 -0.3503 3.4528 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6845 -2.2861 4.5846 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7278 -2.8131 2.8847 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2437 -2.8332 3.9309 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3096 2.4521 2.4786 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0818 -0.5917 -1.0216 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5515 0.3246 -2.7814 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8678 1.7393 -1.7124 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6700 0.0481 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6264 -1.7861 -0.4522 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4082 -1.9750 -0.3908 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5391 -1.9176 -2.0069 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3939 0.7494 0.2072 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8375 1.5636 0.4254 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1164 -0.0838 1.1012 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7798 3.3482 -1.2837 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6388 -0.2659 -2.5204 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3267 1.6572 -4.5251 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0751 1.4540 -4.4176 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1235 -0.0082 -4.7021 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5059 2.9999 -0.5319 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9383 -0.1129 -3.7145 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4933 1.5316 -3.2783 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8891 0.6761 -4.7492 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8032 -0.2073 -3.5219 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 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 8 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 16 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 2 0 22 23 1 0 23 24 1 0 24 25 1 0 24 26 1 0 23 27 1 0 27 28 1 0 27 29 2 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 30 35 1 0 35 36 1 0 35 37 2 0 37 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 40 42 2 0 42 43 1 0 43 44 1 0 43 45 1 0 45 46 2 0 45 47 1 0 47 14 1 0 1 48 1 0 1 49 1 0 1 50 1 0 2 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 6 59 1 0 6 60 1 0 7 61 1 0 7 62 1 0 9 63 1 0 9 64 1 0 9 65 1 0 10 66 1 0 10 67 1 0 10 68 1 0 11 69 1 0 11 70 1 0 12 71 1 0 12 72 1 0 13 73 1 0 13 74 1 0 14 75 1 6 15 76 1 0 15 77 1 0 17 78 1 0 19 79 1 0 19 80 1 0 21 81 1 0 23 82 1 1 24 83 1 0 25 84 1 0 25 85 1 0 25 86 1 0 26 87 1 0 26 88 1 0 26 89 1 0 28 90 1 0 30 91 1 1 31 92 1 0 31 93 1 0 32 94 1 0 33 95 1 0 33 96 1 0 33 97 1 0 34 98 1 0 34 99 1 0 34100 1 0 36101 1 0 38102 1 6 39103 1 0 39104 1 0 39105 1 0 41106 1 0 43107 1 6 44108 1 0 44109 1 0 44110 1 0 M END