RDKit 3D 46 48 0 0 0 0 0 0 0 0999 V2000 -3.5280 0.9716 1.9866 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4611 -0.2678 1.0954 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2209 -1.1306 1.3621 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9515 -0.6774 0.6372 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1760 -0.3917 -0.8541 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4005 0.4925 -1.1885 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6484 0.0287 -0.4013 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7039 0.3399 -2.6994 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1031 1.9848 -0.9615 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1331 -1.7771 0.7709 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0271 -2.9262 0.3649 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2223 -1.2520 1.4040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0054 0.0480 1.7096 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 0.8128 2.2026 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2609 0.3940 1.3219 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4485 -1.9691 1.6878 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5087 -1.7096 0.6141 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0546 -2.6532 0.0486 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8159 -0.3735 0.4624 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7019 0.1793 -0.4253 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9323 1.4722 -0.4321 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8505 1.7739 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2983 0.7013 -2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5430 -0.7297 -1.5963 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 0.6746 3.0395 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6597 1.6214 1.8928 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4204 1.5645 1.7599 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 -0.8716 1.3962 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4621 -2.1508 1.0307 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -1.2104 2.4428 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3106 -1.3583 -1.3614 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2696 0.0428 -1.2986 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0025 -0.9079 -0.8569 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4692 0.7447 -0.5388 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9309 -0.7004 -2.9592 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5661 0.9493 -2.9936 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8481 0.6527 -3.3087 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8541 2.2250 0.0692 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2578 2.3130 -1.5777 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9665 2.6021 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5737 1.3500 1.4214 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -1.6455 2.6551 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2413 -3.0435 1.7261 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3942 0.3161 1.0809 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1607 2.8023 -1.5586 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0070 0.6889 -2.9731 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 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 6 9 1 0 4 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 12 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 7 2 1 0 4 15 1 1 24 20 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 1 3 29 1 0 3 30 1 0 5 31 1 0 5 32 1 0 7 33 1 0 7 34 1 0 8 35 1 0 8 36 1 0 8 37 1 0 9 38 1 0 9 39 1 0 9 40 1 0 15 41 1 0 16 42 1 0 16 43 1 0 19 44 1 0 22 45 1 0 23 46 1 0 M END