RDKit 3D 45 45 0 0 0 0 0 0 0 0999 V2000 7.4596 -0.0883 -1.0583 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6885 0.7588 -0.0694 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4677 0.9880 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4091 0.0491 0.2417 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2547 0.6183 -0.0577 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0237 -0.0868 0.2523 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8548 0.4538 -0.0338 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6419 -0.2714 0.2863 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7265 -1.3990 0.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 0.3114 -0.0219 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8127 -0.4204 0.3015 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6547 -0.7567 -0.6417 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8923 -1.4936 -0.4202 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7929 -2.7179 -1.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0727 -0.7817 -1.0658 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2367 0.5831 -0.4937 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3770 1.2926 -1.1058 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7795 2.6102 -0.7639 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0404 0.6969 -1.9892 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1329 -1.8392 0.9633 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3102 -1.5173 1.9287 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0785 -0.7807 1.6871 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -0.4696 2.6068 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2796 -1.1605 -0.8692 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0707 0.1946 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5341 0.1462 -0.9764 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4586 1.7309 -0.5388 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7825 1.4148 1.9522 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2758 1.7261 1.0325 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9182 0.0375 1.5507 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3968 -0.9237 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2259 1.6077 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0859 -1.0537 0.7175 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8132 1.4455 -0.5104 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6535 1.2417 -0.4691 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3551 -0.4331 -1.6572 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3870 -3.3936 -0.7691 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8194 -0.6768 -2.1405 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9657 -1.4155 -0.9726 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3684 0.5992 0.6031 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3034 1.1576 -0.7169 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0516 3.2940 -0.4356 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7444 2.9549 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0547 -2.4048 1.2392 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5862 -1.8287 2.9521 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 6 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 17 19 2 0 13 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 22 11 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 3 28 1 0 3 29 1 0 3 30 1 0 4 31 1 0 5 32 1 0 6 33 1 0 7 34 1 0 10 35 1 0 12 36 1 0 14 37 1 0 15 38 1 0 15 39 1 0 16 40 1 0 16 41 1 0 18 42 1 0 18 43 1 0 20 44 1 0 21 45 1 0 M END