RDKit 3D 51 53 0 0 0 0 0 0 0 0999 V2000 -3.2547 -2.2691 1.1252 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8079 -2.5644 0.8427 N 0 0 0 0 0 4 0 0 0 0 0 0 -0.8534 -1.5107 1.3809 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8919 -1.4701 2.9096 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -0.5586 3.4846 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0776 0.8364 3.0969 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2044 1.9439 3.3060 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2716 1.2871 4.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5661 3.1538 3.7679 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7325 2.2015 1.6331 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7033 3.4831 1.0703 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1121 3.6709 -0.2555 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5319 2.5751 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5489 1.3025 -0.4394 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1697 1.1061 0.8876 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9338 0.1612 -1.2863 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7602 -0.9892 -0.8956 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4082 0.4713 -2.5350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3521 1.7041 -3.1236 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6437 1.8693 -4.3024 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9215 2.7362 -2.3398 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -2.8837 -0.6265 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7594 -1.7444 -1.5891 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0312 -1.4408 -2.0987 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2056 -0.3713 -2.9789 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1129 0.4004 -3.3664 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8428 0.1010 -2.8818 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6668 -0.9656 -1.9997 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4175 -2.3591 2.2014 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4884 -1.2583 0.7824 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8677 -3.0151 0.6121 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -3.4418 1.3293 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1384 -0.5486 0.9437 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1482 -1.7887 1.0365 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7457 -2.4809 3.3087 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8716 -1.1218 3.2569 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1815 -0.6303 4.5775 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -0.8918 3.1229 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9018 1.2661 3.5306 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3715 4.3410 1.6547 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0931 4.6716 -0.6823 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2262 0.1162 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6697 -0.2915 -3.1422 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9074 3.6488 -2.7806 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5309 -3.2669 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2135 -3.7240 -0.8827 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9024 -2.0369 -1.8356 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1931 -0.1447 -3.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 1.2253 -4.0631 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0109 0.6912 -3.2078 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3385 -1.1960 -1.6549 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 7 8 2 0 7 9 2 0 7 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 2 22 1 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 15 10 1 0 21 13 1 0 28 23 1 0 1 29 1 0 1 30 1 0 1 31 1 0 2 32 1 0 3 33 1 0 3 34 1 0 4 35 1 0 4 36 1 0 5 37 1 0 5 38 1 0 6 39 1 0 11 40 1 0 12 41 1 0 15 42 1 0 18 43 1 0 21 44 1 0 22 45 1 0 22 46 1 0 24 47 1 0 25 48 1 0 26 49 1 0 27 50 1 0 28 51 1 0 M CHG 1 2 1 M END