RDKit 3D 80 82 0 0 0 0 0 0 0 0999 V2000 3.8800 -2.6786 3.7232 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7997 -3.0790 3.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -3.2079 3.9725 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6269 -3.4834 1.7102 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7883 -3.6526 0.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5232 -2.8154 1.0358 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5849 -1.4679 0.5038 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7046 -0.6476 0.4991 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8391 -1.1149 1.0311 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6794 0.6461 -0.0509 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 1.5078 -0.1019 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6628 2.6358 -0.7243 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1751 1.3607 0.4349 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1108 1.3514 1.9647 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1252 2.4889 0.0388 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7033 3.8341 0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4868 1.1216 -0.6157 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3387 2.3309 -1.1705 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3661 0.3042 -0.6132 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4233 -0.9320 -0.0747 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7569 -1.4873 -0.1981 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5894 -0.6517 -0.8025 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9171 -0.7495 -1.1608 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6683 -1.9461 -0.8749 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9003 -1.9602 -1.2021 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1279 -3.1530 -0.2409 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1130 -3.8426 -1.1399 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2556 -4.1580 -0.0215 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7687 -5.4236 0.6213 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5671 0.3201 -1.8018 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9025 0.1905 -2.1521 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9065 1.4969 -2.0946 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6471 2.6265 -2.7578 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5076 3.3546 -1.8363 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4337 4.6438 -1.6631 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4546 5.4633 -2.4049 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3451 5.3406 -0.7011 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5806 1.5692 -1.7295 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8988 2.7167 -2.0129 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9292 0.5219 -1.0962 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8527 -2.4107 4.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 -2.6129 3.1867 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7921 -3.8542 3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8161 -3.6547 4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0853 -2.2152 4.1522 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2728 -4.6085 1.8517 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -3.6415 0.0116 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1543 -3.5339 0.1866 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5799 -2.8966 1.7126 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6982 -1.1973 1.3016 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6294 0.4252 0.1018 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0801 1.2440 2.3433 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7766 0.6038 2.4015 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4316 2.3722 2.3208 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1119 2.2635 0.4702 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2420 2.5228 -1.0704 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7203 4.6309 -0.2769 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3092 4.1775 1.4052 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6712 3.7998 0.9038 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7868 3.1300 -1.3662 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6661 -2.9572 0.7321 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7692 -3.2237 -1.9657 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2559 -4.1632 -0.5293 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5395 -4.7630 -1.5965 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6526 -4.4231 -1.0327 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0745 -3.7493 0.6022 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7893 -5.7529 0.2141 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4781 -6.2394 0.3639 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7653 -5.3472 1.7411 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3751 0.9245 -2.6199 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2550 2.2362 -3.6322 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9525 3.3415 -3.2436 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2531 2.8096 -1.2524 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5049 5.2626 -3.4993 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4592 5.3737 -1.9603 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7612 6.5606 -2.3449 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3465 4.8743 -0.6338 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4203 6.4136 -1.0212 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9190 5.3608 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1547 3.5428 -2.4545 H 0 0 0 0 0 0 0 0 0 0 0 0 29 28 1 0 28 26 1 0 26 27 1 0 26 24 1 0 24 25 2 0 24 23 1 0 23 30 2 0 30 31 1 0 30 32 1 0 32 33 1 0 33 34 1 0 34 35 2 3 35 36 1 0 35 37 1 0 32 38 2 0 38 39 1 0 38 40 1 0 40 22 2 0 22 21 1 0 21 20 1 0 20 19 2 0 19 17 1 0 17 18 1 0 17 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 10 8 1 0 8 9 1 0 8 7 2 0 7 6 1 0 6 4 1 0 4 5 1 0 4 2 1 0 2 3 1 0 2 1 2 3 22 23 1 0 7 20 1 0 19 40 1 0 29 67 1 0 29 68 1 0 29 69 1 0 28 65 1 0 28 66 1 0 26 61 1 1 27 62 1 0 27 63 1 0 27 64 1 0 31 70 1 0 33 71 1 0 33 72 1 0 34 73 1 0 36 74 1 0 36 75 1 0 36 76 1 0 37 77 1 0 37 78 1 0 37 79 1 0 39 80 1 0 18 60 1 0 13 51 1 6 14 52 1 0 14 53 1 0 14 54 1 0 15 55 1 0 15 56 1 0 16 57 1 0 16 58 1 0 16 59 1 0 9 50 1 0 6 48 1 0 6 49 1 0 4 46 1 1 5 47 1 0 3 43 1 0 3 44 1 0 3 45 1 0 1 41 1 0 1 42 1 0 M END