RDKit 3D 55 61 0 0 0 0 0 0 0 0999 V2000 5.2213 0.1377 1.4099 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6513 1.1385 0.4126 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 0.5270 -0.2064 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8506 -1.0413 -1.0934 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -1.7198 -1.6384 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8602 -0.2908 -1.0963 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5193 0.9250 -1.6839 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9362 1.4994 -2.6353 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7567 1.3729 -1.1509 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3205 2.6428 -1.5302 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5614 -0.4293 -1.3429 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8597 -1.4835 -2.2249 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1812 -0.6974 0.0203 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4451 0.0149 0.1463 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6698 -0.5788 0.3317 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6119 0.3802 0.3975 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9997 1.5706 0.2567 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4975 2.8751 0.2509 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6293 3.9224 0.0886 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2621 3.7150 -0.0704 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7647 2.4300 -0.0655 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6579 1.3794 0.0996 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4179 -2.1590 0.1379 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1945 -3.0556 -0.6101 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2693 -4.4001 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5372 -4.8594 0.7526 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7757 -3.9883 1.4881 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6925 -2.6244 1.2072 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0394 -1.5903 1.8500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1605 -0.4073 1.0397 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0910 -0.1743 0.3502 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4057 0.1281 0.7872 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7518 0.0812 1.9877 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3385 0.0820 1.3295 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0047 0.5242 2.4287 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8258 -0.8852 1.2449 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4213 1.2998 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3615 2.0777 0.8897 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 2.5784 -1.7697 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1445 3.3580 -0.6996 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7401 3.0436 -2.4121 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0319 0.4693 -1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0048 -1.7375 -2.6583 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8925 -1.6570 0.4201 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6517 0.2437 0.5346 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5583 3.0161 0.3753 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0568 4.9332 0.0892 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5943 4.5560 -0.1968 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7221 2.1887 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7697 -2.7052 -1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 -5.0820 -0.9086 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6073 -5.9211 0.9643 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2088 -4.3606 2.3266 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5935 -1.6638 2.7079 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 0.4011 1.7501 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 3 2 1 1 3 4 1 0 4 5 1 0 6 5 1 6 6 11 1 0 11 12 1 0 11 13 1 0 13 30 1 0 30 29 1 0 29 28 1 0 28 27 2 0 27 26 1 0 26 25 2 0 25 24 1 0 24 23 2 0 30 31 1 0 31 32 1 0 32 33 2 0 13 14 1 1 14 15 2 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 32 3 1 0 22 14 1 0 9 3 1 0 31 6 1 0 22 17 1 0 23 13 1 0 23 28 1 0 1 34 1 0 1 35 1 0 1 36 1 0 2 37 1 0 2 38 1 0 11 42 1 6 12 43 1 0 30 55 1 1 29 54 1 0 27 53 1 0 26 52 1 0 25 51 1 0 24 50 1 0 15 44 1 0 16 45 1 0 18 46 1 0 19 47 1 0 20 48 1 0 21 49 1 0 10 39 1 0 10 40 1 0 10 41 1 0 M END