RDKit 3D 54 53 0 0 0 0 0 0 0 0999 V2000 -0.0919 -1.3072 -1.8978 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7078 -1.6827 -0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0208 -0.5011 -0.0001 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7394 -0.6681 1.1274 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1473 -0.1548 0.9952 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7042 0.1837 -0.1317 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0891 0.6744 -0.1497 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6818 1.0261 -1.2804 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0812 1.5229 -1.3062 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8296 1.0585 -0.0698 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1535 2.8902 -1.4907 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1476 -0.2641 2.4452 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0942 -0.9872 2.7306 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3036 -0.7404 1.9855 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 0.1451 1.0735 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9407 0.1373 0.4817 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 1.1112 -0.4861 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8235 -0.6825 0.8222 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1508 -0.9193 0.4473 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7594 -0.0113 -0.5808 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9744 1.4009 -0.0896 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1699 -0.5606 -0.8874 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0739 -0.0402 -1.8001 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -0.4666 -1.6404 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7684 -2.1846 -2.0993 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5601 -1.0823 -2.7663 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0798 -2.3225 -0.0127 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -2.2718 -0.9443 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9042 -1.7978 1.2306 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7061 -0.0730 1.9086 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1508 0.1022 -1.0327 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6697 0.7647 0.7576 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0942 0.9338 -2.1914 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6089 1.0363 -2.1758 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4963 0.0125 0.1182 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5741 1.6497 0.8146 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9280 1.0038 -0.2592 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5885 3.3679 -0.8339 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9378 -0.5354 3.2147 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0719 0.8431 2.5535 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3631 -0.8136 3.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0646 -2.1219 2.7413 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1455 -1.4303 2.2391 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8599 0.8872 0.7937 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8712 2.0583 -0.2643 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2031 -1.9570 -0.0151 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8720 -0.9816 1.3014 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6652 2.1747 -0.8177 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0643 1.6085 0.1015 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4876 1.5012 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8498 -0.2940 -0.0439 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1335 -1.6634 -0.9794 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5615 -0.0548 -1.7837 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5992 0.4762 -2.4451 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 16 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 20 23 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 9 11 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 2 28 1 0 4 29 1 1 12 39 1 0 12 40 1 0 13 41 1 0 13 42 1 0 14 43 1 0 15 44 1 0 17 45 1 0 19 46 1 0 19 47 1 0 21 48 1 0 21 49 1 0 21 50 1 0 22 51 1 0 22 52 1 0 22 53 1 0 23 54 1 0 5 30 1 0 6 31 1 0 7 32 1 0 8 33 1 0 9 34 1 6 10 35 1 0 10 36 1 0 10 37 1 0 11 38 1 0 M END