RDKit 3D 50 53 0 0 0 0 0 0 0 0999 V2000 4.7584 -1.5469 -3.3659 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6126 -0.7635 -3.5579 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8771 -0.2182 -2.5153 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -0.4776 -1.2337 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6331 0.0368 -0.1391 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5142 0.8030 -0.2939 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8178 1.3274 0.9151 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7496 1.8431 1.8138 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0434 0.2589 1.5388 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9959 -0.2135 0.4965 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7735 -1.3716 -0.2235 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6667 -1.7820 -1.1761 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7921 -1.0183 -1.4037 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0086 0.1365 -0.6819 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1092 0.5720 0.2942 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3289 1.8011 1.0709 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6546 1.8272 2.3927 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8001 0.7007 2.6595 N 0 0 0 0 0 4 0 0 0 0 0 0 -0.0183 1.0032 3.8317 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6951 -0.4103 3.0292 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5166 -1.6578 -2.4092 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0267 -2.9758 -2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7264 -2.8752 -2.0492 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0832 1.0533 -1.5802 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7655 0.5426 -2.6796 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3301 0.7957 -3.9711 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5325 -2.4095 -2.7241 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2362 -1.8134 -4.3076 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5006 -0.9035 -2.8108 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2029 -1.0797 -1.0634 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0029 -0.1821 0.8524 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2085 2.1844 0.5619 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3421 2.6061 2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6055 -0.5804 1.8822 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1261 -1.9484 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8872 0.7550 -0.8425 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4417 1.8489 1.2681 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1269 2.6966 0.4495 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3739 1.8903 3.2514 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0453 2.7513 2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0958 2.0907 4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0405 0.7445 3.7513 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3953 0.4636 4.7494 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9069 -1.0596 2.1569 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1968 -1.0077 3.8007 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6444 -0.0308 3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6629 -3.6438 -1.9666 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 -3.2740 -3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1913 1.6642 -1.6984 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5015 1.3628 -4.0943 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 24 1 0 24 25 2 0 25 26 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 21 1 0 21 22 1 0 22 23 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 25 3 1 0 18 9 1 0 15 10 1 0 23 12 1 0 1 27 1 0 1 28 1 0 1 29 1 0 4 30 1 0 5 31 1 0 24 49 1 0 26 50 1 0 7 32 1 6 8 33 1 0 9 34 1 1 11 35 1 0 22 47 1 0 22 48 1 0 14 36 1 0 16 37 1 0 16 38 1 0 17 39 1 0 17 40 1 0 19 41 1 0 19 42 1 0 19 43 1 0 20 44 1 0 20 45 1 0 20 46 1 0 M CHG 1 18 1 M END