RDKit 3D 132131 0 0 0 0 0 0 0 0999 V2000 1.9848 1.1794 5.0724 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7154 1.0410 3.7409 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2458 -0.3537 3.6512 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9814 -0.6570 2.3879 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1986 0.2529 2.1754 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8129 -0.1806 0.9129 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9467 0.5845 -0.1329 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4975 1.9931 -0.1919 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6813 2.8333 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7691 3.5552 -1.5349 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7985 3.6734 -2.6288 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4715 3.2947 -3.9362 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0014 1.9097 -4.0215 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8218 0.9221 -3.9298 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3043 -0.4727 -4.0215 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3064 -1.5343 -3.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2332 -1.7342 -4.9051 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1898 -0.7317 -5.1146 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 0.2138 -5.9324 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9796 -0.7613 -4.3953 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0152 0.2238 -4.6178 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3879 0.7838 -3.3835 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3138 -0.1834 -2.6476 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1779 -1.2690 -1.9929 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3933 -1.4719 -1.9798 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8255 -2.1593 -1.3269 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2244 -3.2246 -0.4842 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5279 -2.6848 0.7142 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4115 -1.8870 1.6151 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5137 -2.7875 2.0764 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5048 -2.1193 2.9526 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9532 -1.5457 4.2395 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1607 -0.9138 4.9986 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7432 -0.3031 6.2692 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6889 0.4199 7.1139 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8809 -0.1726 7.7094 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9098 -0.6602 6.7706 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3833 0.4890 5.8786 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4393 -0.0021 4.9135 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6481 -0.5496 5.6079 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1128 -0.3861 -5.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0564 0.6002 -5.7269 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3666 0.1449 -6.6495 P 0 0 1 0 0 5 0 0 0 0 0 0 -2.2282 0.7455 -8.0283 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4888 -1.5377 -6.7897 O 0 0 0 0 0 1 0 0 0 0 0 0 -3.7437 0.7932 -5.9227 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7605 -0.0963 -5.7262 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8944 0.6252 -5.0702 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5920 1.2049 -3.8041 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.7465 1.3114 -2.9259 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5615 0.5015 -3.0721 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1223 2.5613 -4.0144 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0075 0.6696 5.0098 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 0.7228 5.8923 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8062 2.2624 5.2582 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0362 1.2524 2.9134 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 1.7652 3.7293 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8955 -0.5617 4.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3566 -1.0398 3.6705 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3148 -0.5342 1.5175 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3178 -1.7071 2.4232 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8887 1.2736 2.2753 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9706 -0.0086 2.9788 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1707 -1.2336 0.8909 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4336 0.1314 -1.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7287 2.0578 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 2.2996 0.7587 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4967 2.8510 0.2649 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6893 4.1735 -1.6655 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5805 4.7767 -2.7422 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8441 3.1845 -2.5177 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6657 3.4496 -4.7169 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2463 4.0703 -4.1531 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4062 1.7755 -5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7403 1.6899 -3.2486 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1669 1.2412 -4.7466 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3519 1.1063 -2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0741 -0.6485 -3.1916 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9352 -0.6177 -4.9738 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8276 -2.5563 -3.7962 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7979 -1.4784 -2.8766 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6606 -2.6687 -4.5435 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6741 -2.0717 -5.8975 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4184 1.0091 -5.2664 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 1.1745 -2.7368 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2804 1.6315 -3.5677 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4542 -2.6328 -2.1135 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5224 -1.5346 -0.7183 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9614 -3.9468 -0.1757 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -3.7308 -1.1193 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8698 -3.5584 1.3065 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4187 -2.1046 0.4367 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1925 -1.6204 2.5173 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -0.9996 1.1155 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0922 -3.2249 1.2105 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1047 -3.6757 2.6367 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 -2.8905 3.2673 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0803 -1.3207 2.4068 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2052 -0.7845 4.0261 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5194 -2.3526 4.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7164 -0.3296 4.2885 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7643 -1.8389 5.2555 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2105 -1.0723 6.9354 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8993 0.4163 6.0234 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0559 0.9320 7.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0197 1.3811 6.5516 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6466 -0.9351 8.5186 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3683 0.6527 8.3441 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8532 -0.9868 7.3245 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6591 -1.5020 6.1397 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5242 0.8800 5.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7969 1.2425 6.5589 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7613 0.8336 4.2615 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0288 -0.7985 4.2594 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4016 -1.5140 6.1052 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3894 -0.8021 4.8123 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1170 0.1503 6.3168 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3897 -0.5916 -6.4745 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4816 -1.3244 -5.1045 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4855 -0.9750 -5.1104 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1436 -0.4989 -6.7027 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2355 1.4619 -5.7429 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7914 -0.0198 -4.9367 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3401 1.7273 -1.9576 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2788 0.3720 -2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3728 2.1416 -3.3434 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5402 0.7793 -3.4105 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6468 -0.5817 -3.1005 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6115 0.7980 -1.9996 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9673 3.2921 -3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6603 2.7240 -5.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4028 2.8906 -3.2095 H 0 0 0 0 0 0 0 0 0 0 0 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 21 41 1 0 41 42 1 0 42 43 1 0 43 45 1 6 43 44 2 0 43 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 49 51 1 0 49 52 1 0 21 20 1 0 20 18 1 0 18 19 2 0 18 17 1 0 17 16 1 0 16 15 1 0 15 14 1 0 14 13 1 0 13 12 1 0 12 11 1 0 11 10 1 0 10 9 2 0 9 8 1 0 8 7 1 0 7 6 2 0 6 5 1 0 5 4 1 0 4 3 1 0 3 2 1 0 2 1 1 0 21 84 1 6 22 85 1 0 22 86 1 0 26 87 1 0 26 88 1 0 27 89 1 0 27 90 1 0 28 91 1 0 28 92 1 0 29 93 1 0 29 94 1 0 30 95 1 0 30 96 1 0 31 97 1 0 31 98 1 0 32 99 1 0 32100 1 0 33101 1 0 33102 1 0 34103 1 0 34104 1 0 35105 1 0 35106 1 0 36107 1 0 36108 1 0 37109 1 0 37110 1 0 38111 1 0 38112 1 0 39113 1 0 39114 1 0 40115 1 0 40116 1 0 40117 1 0 41118 1 0 41119 1 0 47120 1 0 47121 1 0 48122 1 0 48123 1 0 50124 1 0 50125 1 0 50126 1 0 51127 1 0 51128 1 0 51129 1 0 52130 1 0 52131 1 0 52132 1 0 17 82 1 0 17 83 1 0 16 80 1 0 16 81 1 0 15 78 1 0 15 79 1 0 14 76 1 0 14 77 1 0 13 74 1 0 13 75 1 0 12 72 1 0 12 73 1 0 11 70 1 0 11 71 1 0 10 69 1 0 9 68 1 0 8 66 1 0 8 67 1 0 7 65 1 0 6 64 1 0 5 62 1 0 5 63 1 0 4 60 1 0 4 61 1 0 3 58 1 0 3 59 1 0 2 56 1 0 2 57 1 0 1 53 1 0 1 54 1 0 1 55 1 0 M CHG 2 45 -1 49 1 M END