RDKit 3D 45 48 0 0 0 0 0 0 0 0999 V2000 3.0792 4.0670 -0.5703 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5825 2.8592 -1.1392 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2009 2.8289 -1.1931 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5222 4.2735 -0.5654 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0629 4.9240 -0.2145 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3133 1.7341 -1.7226 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2152 0.9104 -0.6235 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7162 0.1396 0.1379 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7142 0.1963 1.5404 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6487 -0.5280 2.2866 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6023 -1.3051 1.6378 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6088 -1.3765 0.2434 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6856 -0.6427 -0.5032 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.1429 -0.4644 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1469 -3.1027 0.3803 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6156 -2.4502 1.6705 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4999 -1.9710 2.4306 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5641 1.0772 -0.2856 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2396 2.0055 -0.7416 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2015 0.0431 0.6279 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5301 -0.3267 0.1612 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7057 0.3040 0.4483 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6918 -0.4324 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0236 -1.5217 -0.7838 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6945 -1.4570 -0.5568 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6621 -2.6252 -1.5847 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1626 -2.7156 -2.8465 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.5026 -3.8463 -1.0063 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.0064 -2.4415 -1.7189 F 0 0 0 0 0 0 0 0 0 0 0 0 4.1284 4.2958 -0.4299 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2113 2.0477 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1486 5.9041 0.2342 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5051 2.1671 -2.3101 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8654 1.0981 -2.4231 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0294 0.8493 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6493 -0.4631 3.3715 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7127 -0.7334 -1.5847 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4459 -3.9235 0.5762 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 -3.5074 -0.1715 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1511 -3.1767 2.2895 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 -1.6072 1.4721 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3091 0.4618 1.6333 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6275 -0.8857 0.6799 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7371 1.2171 1.0272 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7528 -0.2210 -0.1657 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 3 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 7 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 26 28 1 0 26 29 1 0 5 1 2 0 13 8 1 0 17 11 1 0 25 21 1 0 1 30 1 0 2 31 1 0 5 32 1 0 6 33 1 0 6 34 1 0 9 35 1 0 10 36 1 0 13 37 1 0 15 38 1 0 15 39 1 0 16 40 1 0 16 41 1 0 20 42 1 0 20 43 1 0 22 44 1 0 23 45 1 0 M END