RDKit 3D 120125 0 0 0 0 0 0 0 0999 V2000 1.8923 1.7372 -4.7839 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3024 0.8517 -3.7754 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6782 -0.1695 -4.1653 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3847 1.0614 -2.4057 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7692 0.1215 -1.5101 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9872 0.5361 -0.0502 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4939 0.5731 0.1204 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9415 1.5984 0.9929 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 2.5180 0.6604 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3928 3.5954 1.5623 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4263 2.4179 -0.4856 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1303 -0.7373 0.5326 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0404 -1.2670 -0.4109 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4092 -1.3510 -0.2362 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8689 -0.9088 0.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3261 -1.9250 -1.2673 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7604 -1.7968 -0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0913 -3.4127 -1.4176 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2727 -1.7315 1.1881 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3235 -0.8151 2.0226 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8602 -1.6445 3.0078 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2514 -1.4186 4.3236 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7675 -2.2933 5.4013 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0162 -0.4745 4.6181 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -0.4651 0.9041 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2582 -1.6471 0.1295 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2886 -2.4758 0.3972 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9295 -3.2161 -0.7725 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6738 -3.6842 1.1356 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0763 -4.3306 0.1153 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0468 -5.2735 0.1919 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7288 -6.4936 -0.1357 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4459 -5.1522 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8618 -6.0645 1.5693 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 -6.1101 2.0738 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0017 -5.2214 1.6057 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6671 -4.2936 0.6449 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3669 -4.2590 0.1302 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1341 -3.2331 -0.9254 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4815 -3.8071 -2.2786 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8081 -1.9207 -0.6390 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1615 -1.7619 -1.2765 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9453 -0.7608 -1.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7492 -0.7736 -2.3582 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4026 0.1986 -0.3922 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8159 0.6995 0.6743 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0300 1.9814 0.5526 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8546 2.9308 -0.0838 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4285 4.0345 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1576 4.1558 1.7678 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2647 4.9938 -0.1172 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5605 4.8758 -1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3674 5.8063 -2.0526 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8573 6.8429 -1.2856 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6024 7.7020 -1.8483 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5648 6.9593 0.0254 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0930 8.0610 0.8175 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7815 6.0462 0.5915 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3552 1.8997 0.0259 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5710 2.5354 -1.1898 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1911 3.7189 -1.4089 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4372 4.3876 -2.7004 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5643 4.2373 -0.3619 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9122 -0.1624 1.5312 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8616 0.5390 2.8953 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5625 -1.3698 1.8592 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0072 1.1908 -5.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 2.5532 -4.9932 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8304 2.2024 -4.4602 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2589 0.1695 -1.8514 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1702 -0.8339 -1.7878 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0422 0.7889 -0.8449 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4965 3.5873 1.6292 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1258 4.6129 1.1576 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9252 3.4339 2.5516 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8362 -0.4351 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2952 -1.3787 -2.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5088 -1.8435 -1.5385 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9257 -2.5394 0.0567 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8058 -0.7949 -0.2161 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1790 -3.8343 -0.3788 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8832 -3.8288 -2.0379 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0763 -3.5481 -1.8081 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8318 -2.3233 1.9357 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9304 0.0354 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5043 -3.1122 5.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6254 -1.6545 6.3033 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2086 -2.7570 5.1734 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0718 -3.6053 -1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5542 -2.6294 -1.4209 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4478 -4.1189 -0.3787 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -4.3161 1.4614 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0194 -3.4621 1.9454 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1953 -6.8288 1.9915 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0282 -5.2414 2.0047 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4469 -3.6239 0.3308 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0431 -3.0475 -0.9485 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7532 -4.5958 -2.5734 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4991 -3.0719 -3.0774 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4536 -4.3348 -2.1926 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9398 -1.7404 0.4543 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8992 -1.4366 -0.5167 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1082 -0.9033 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5157 -2.6443 -1.8445 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6605 0.9824 1.4166 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9888 2.3731 1.5883 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1526 4.0363 -2.0283 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6082 5.7173 -3.1189 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4650 8.9746 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0497 7.7841 1.9058 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1651 8.2525 0.5963 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 6.1802 1.6591 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9689 2.4977 0.7305 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3895 4.1542 -3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5509 4.1975 -3.3475 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4318 5.4836 -2.5072 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 0.9598 3.1486 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1458 -0.1610 3.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7347 1.2622 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5932 -1.9790 1.1059 H 0 0 0 0 0 0 0 0 0 0 0 0 17 16 1 0 16 18 1 0 16 14 1 0 14 15 2 0 14 13 1 0 13 12 1 0 12 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 2 0 20 25 1 0 25 26 1 6 26 27 1 0 27 28 1 6 27 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 31 33 1 0 33 34 2 0 34 35 1 0 35 36 2 0 36 37 1 0 37 38 2 0 38 39 1 0 39 40 1 0 39 41 1 0 41 42 1 0 41 43 1 0 43 44 2 0 43 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 2 0 49 51 1 0 51 58 2 0 58 56 1 0 56 57 1 0 56 54 1 0 54 55 2 0 54 53 1 0 53 52 2 0 47 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 61 63 2 0 59 6 1 0 6 5 1 6 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 2 0 46 64 1 0 64 65 1 0 64 66 1 1 7 12 1 0 27 19 1 0 38 33 1 0 52 51 1 0 6 25 1 0 64 25 1 0 17 78 1 0 17 79 1 0 17 80 1 0 16 77 1 0 18 81 1 0 18 82 1 0 18 83 1 0 12 76 1 1 19 84 1 1 20 85 1 1 23 86 1 0 23 87 1 0 23 88 1 0 28 89 1 0 28 90 1 0 28 91 1 0 29 92 1 0 29 93 1 0 34 94 1 0 36 95 1 0 37 96 1 0 39 97 1 6 40 98 1 0 40 99 1 0 40100 1 0 41101 1 1 42102 1 0 42103 1 0 42104 1 0 46105 1 1 47106 1 1 58112 1 0 57109 1 0 57110 1 0 57111 1 0 53108 1 0 52107 1 0 59113 1 1 62114 1 0 62115 1 0 62116 1 0 5 70 1 0 5 71 1 0 1 67 1 0 1 68 1 0 1 69 1 0 7 72 1 6 10 73 1 0 10 74 1 0 10 75 1 0 65117 1 0 65118 1 0 65119 1 0 66120 1 0 M END