RDKit 3D 78 83 0 0 0 0 0 0 0 0999 V2000 0.8182 4.1005 3.4696 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0881 2.8342 3.2739 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6368 2.3446 4.1868 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1737 2.1483 2.0932 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4926 0.9339 1.8299 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2236 0.4009 0.4609 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9219 1.2283 -0.5937 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4168 1.2116 -0.4066 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9446 -0.1724 -0.4248 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2439 -1.1091 0.5619 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6791 -2.5331 0.2539 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 -2.6330 -0.7227 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1157 -2.7269 -0.0622 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7834 -1.6561 -0.8455 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4411 -1.4685 -2.1894 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.8525 -2.7510 -2.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5684 -0.5431 -2.1588 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4862 0.5555 -1.4193 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2563 0.7717 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9139 1.9495 -0.4269 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4035 -0.3363 -0.1941 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6717 -0.4411 1.3086 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -1.0138 0.2994 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0891 -1.8008 1.1849 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4291 -1.1111 1.0762 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1938 0.0919 0.1452 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2157 1.1342 0.3144 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9927 2.3023 -0.5952 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5901 0.5138 0.1195 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8460 0.0079 -1.2543 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1878 -0.6095 -1.3221 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4774 -1.7515 -2.2445 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1536 -0.1480 -0.5557 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5249 -0.7641 -0.6165 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4899 0.1423 -0.9838 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9001 0.9468 0.3853 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8552 1.3605 1.0963 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6105 1.4661 0.4343 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3662 4.8715 2.8045 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9027 4.0004 3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7845 4.4554 4.5144 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2399 0.1909 2.6353 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5776 1.1457 1.9996 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6344 2.3117 -0.4394 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6676 0.8606 -1.5846 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8162 1.7098 -1.3431 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7517 1.8396 0.4315 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -0.6044 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5221 -0.9028 1.6061 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8187 -3.1311 -0.1816 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8942 -3.0862 1.2016 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7719 -3.4912 -1.4605 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 -1.0919 -2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2361 -2.6819 -3.5041 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4845 -0.7153 -2.7217 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3004 1.2692 -1.3691 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1102 0.3358 1.8768 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7575 -0.1883 1.4659 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5539 -1.4556 1.6912 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5996 -1.2983 -0.7535 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1416 -2.8592 0.8458 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -1.7924 2.2367 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1236 -1.8138 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 -0.7997 2.0768 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2104 -0.3338 -0.8845 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2374 1.5393 1.3521 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5452 3.1885 -0.0837 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4524 2.0310 -1.5405 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9749 2.7145 -0.9866 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7151 -0.3309 0.8249 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0507 -0.7044 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9052 0.8704 -1.9905 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5621 -1.9522 -2.8304 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7994 -2.6613 -1.7008 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2717 -1.4315 -2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -1.6079 -1.3243 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7774 -1.2057 0.3834 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3642 -0.0696 -0.5428 H 0 0 0 0 0 0 0 0 0 0 0 0 28 27 1 0 27 26 1 0 26 25 1 0 25 24 1 0 24 23 1 0 23 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 14 13 1 1 14 15 1 0 15 16 1 0 15 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 1 21 9 1 0 9 8 1 0 8 7 1 0 7 6 1 0 6 5 1 1 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 27 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 2 0 33 34 1 0 34 35 1 0 33 36 1 0 36 37 2 0 36 38 1 0 6 26 1 0 38 29 1 0 6 23 1 0 9 10 1 0 14 12 1 0 21 14 1 0 28 67 1 0 28 68 1 0 28 69 1 0 27 66 1 1 26 65 1 6 25 63 1 0 25 64 1 0 24 61 1 0 24 62 1 0 23 60 1 6 10 49 1 1 11 50 1 0 11 51 1 0 12 52 1 6 15 53 1 6 16 54 1 0 17 55 1 0 18 56 1 0 22 57 1 0 22 58 1 0 22 59 1 0 9 48 1 6 8 46 1 0 8 47 1 0 7 44 1 0 7 45 1 0 5 42 1 0 5 43 1 0 1 39 1 0 1 40 1 0 1 41 1 0 29 70 1 1 30 71 1 0 30 72 1 0 32 73 1 0 32 74 1 0 32 75 1 0 34 76 1 0 34 77 1 0 35 78 1 0 M END