RDKit 3D 100102 0 0 0 0 0 0 0 0999 V2000 -9.5990 3.4571 0.2811 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4629 2.5135 -0.0476 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2332 2.7822 0.2875 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1263 1.9013 -0.0206 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8893 2.2251 0.3808 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7303 1.3538 0.0756 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8754 0.1326 -0.7281 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5375 1.7094 0.5095 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2982 0.9962 0.2594 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1535 1.4296 0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1346 0.8187 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1909 1.3366 1.2559 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9722 2.5102 2.1136 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5155 0.7581 1.0684 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6231 1.1755 1.6424 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8854 0.5129 1.3693 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0437 0.8463 1.8938 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1273 1.9724 2.8397 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2756 0.1210 1.5209 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3989 0.4568 2.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6732 -0.1609 1.8129 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6834 0.2854 2.4809 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8457 -1.2322 0.8368 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9558 -2.4050 1.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7685 -0.6650 -0.5565 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0113 0.2391 -0.5415 C 0 0 2 0 0 0 0 0 0 0 0 0 12.3445 0.7107 -1.7839 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0585 -0.6070 0.1227 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3310 -1.6978 0.8562 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8490 -1.8375 2.2433 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4472 -2.9997 0.0958 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7726 1.2473 -0.7101 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0419 0.9914 -1.0369 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4693 -0.2542 -1.7025 C 0 0 1 0 0 0 0 0 0 0 0 0 -11.6019 -0.0646 -2.5415 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2467 -0.5021 -3.0302 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.7218 0.6180 -3.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3960 -1.8550 -3.6483 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4588 -2.9945 -2.6823 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.6821 -4.0907 -3.1215 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9052 -2.6010 -1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6293 -1.4355 -0.7442 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0665 -1.6924 -0.4017 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8980 -1.1054 0.5751 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1558 4.2904 0.8478 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3334 2.9513 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0633 3.8075 -0.6697 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0099 3.7253 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2309 0.9927 -0.5634 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7874 3.1426 0.9289 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7990 -0.4382 -0.4146 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0062 -0.5465 -0.7229 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0633 0.3739 -1.8177 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 2.6297 1.1072 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2445 0.1305 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2556 2.3358 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2879 -0.0130 -0.0697 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1073 2.3662 2.8283 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7627 3.4441 1.5425 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8183 2.7504 2.7807 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6466 -0.1116 0.3959 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5429 2.0111 2.3156 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9344 -0.3423 0.6727 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3356 1.6445 3.8863 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2552 2.6306 2.7565 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0213 2.6283 2.5975 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2373 -0.6659 0.7923 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4273 1.2689 2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3867 -2.5703 0.0621 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3200 -2.3916 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5947 -3.3181 1.1415 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9148 0.0001 -0.6606 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8474 -1.4201 -1.3605 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7435 1.0410 0.1936 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2963 0.9106 -1.8046 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7788 -1.0600 -0.5933 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6572 0.0350 0.8011 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3950 -2.8283 2.3075 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6217 -1.0959 2.5376 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0276 -1.9437 2.9871 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3747 -2.9556 -0.5222 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5397 -3.8395 0.8158 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6070 -3.1515 -0.6089 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0714 0.4876 -0.9671 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7816 1.7502 -0.7909 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6091 1.5661 -3.4133 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6987 0.3316 -4.3061 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4447 0.7400 -4.7493 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4456 -2.0155 -4.2484 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1961 -1.9222 -4.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4701 -3.3813 -2.5364 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4237 -4.6446 -2.3336 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9149 -3.4336 -0.6026 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8348 -2.2719 -1.4609 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4140 -2.5973 -0.9344 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2051 -1.8299 0.6931 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7124 -0.8366 -0.6926 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0964 -0.0845 0.8999 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2401 -1.8666 1.3083 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8024 -1.3106 0.4084 H 0 0 0 0 0 0 0 0 0 0 0 0 13 12 1 0 12 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 17 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 23 21 1 1 23 24 1 0 23 25 1 0 25 26 1 0 26 27 1 0 26 28 1 0 28 29 1 0 29 30 1 0 29 31 1 0 12 11 2 0 11 10 1 0 10 9 2 0 9 8 1 0 8 6 2 0 6 7 1 0 6 5 1 0 5 4 2 0 4 3 1 0 3 2 2 0 2 1 1 0 2 32 1 0 32 33 2 0 34 33 1 1 34 35 1 0 35 36 1 0 36 37 1 6 36 38 1 0 38 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 42 43 1 0 42 44 1 0 29 23 1 0 36 34 1 0 42 34 1 0 13 58 1 0 13 59 1 0 13 60 1 0 14 61 1 0 15 62 1 0 16 63 1 0 18 64 1 0 18 65 1 0 18 66 1 0 19 67 1 0 20 68 1 0 24 69 1 0 24 70 1 0 24 71 1 0 25 72 1 0 25 73 1 0 26 74 1 1 27 75 1 0 28 76 1 0 28 77 1 0 30 78 1 0 30 79 1 0 30 80 1 0 31 81 1 0 31 82 1 0 31 83 1 0 11 57 1 0 10 56 1 0 9 55 1 0 8 54 1 0 7 51 1 0 7 52 1 0 7 53 1 0 5 50 1 0 4 49 1 0 3 48 1 0 1 45 1 0 1 46 1 0 1 47 1 0 32 84 1 0 33 85 1 0 37 86 1 0 37 87 1 0 37 88 1 0 38 89 1 0 38 90 1 0 39 91 1 1 40 92 1 0 41 93 1 0 41 94 1 0 43 95 1 0 43 96 1 0 43 97 1 0 44 98 1 0 44 99 1 0 44100 1 0 M END