RDKit 3D 53 56 0 0 0 0 0 0 0 0999 V2000 1.6262 -2.4478 -2.2085 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3463 -1.0342 -1.7311 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1973 -0.9894 -0.2256 N 0 0 0 0 0 4 0 0 0 0 0 0 0.5613 0.3333 0.2294 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9598 0.2146 0.1997 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6895 1.3748 0.2842 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 1.4059 0.2628 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6743 2.4692 0.3164 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6808 0.0951 0.1598 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0606 -0.2847 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1992 -1.6549 -0.0125 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6907 -2.4625 -0.0666 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8346 -0.9957 0.0858 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4743 -0.9762 0.1111 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2349 0.5699 0.1676 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0418 0.7441 -0.9637 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1750 1.5588 -0.8975 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5016 2.1950 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7046 2.0272 1.4287 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5691 1.2152 1.3638 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8959 3.1978 0.3815 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.4632 -1.3243 0.5616 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6152 -0.3319 0.3606 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3873 0.7906 -0.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8429 -0.8221 0.7554 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1009 -0.2108 0.5096 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1564 -0.5871 1.3477 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4410 -0.0701 1.1997 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6930 0.8453 0.1782 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6620 1.2187 -0.6865 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3806 0.6866 -0.5244 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4569 1.0043 -1.4411 F 0 0 0 0 0 0 0 0 0 0 0 0 6.9200 -1.4637 2.3398 F 0 0 0 0 0 0 0 0 0 0 0 0 2.6416 -2.7631 -1.9504 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9209 -3.1677 -1.7836 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5395 -2.4929 -3.2993 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3977 -0.6879 -2.1567 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1413 -0.3433 -2.0278 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4795 -1.6965 0.0138 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9046 1.1414 -0.4218 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8638 0.5195 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2666 2.2931 0.3398 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1167 -2.2303 -0.0672 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7940 0.2596 -1.9053 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7958 1.6958 -1.7797 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9587 2.5263 2.3615 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9533 1.0962 2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -1.3400 1.6187 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7695 -2.3324 0.2691 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8748 -1.5656 1.4504 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2335 -0.3751 1.8779 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6907 1.2606 0.0476 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8518 1.9114 -1.5015 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 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 10 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 18 21 1 0 3 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 31 32 1 0 27 33 1 0 14 5 2 0 13 9 2 0 20 15 1 0 31 26 1 0 1 34 1 0 1 35 1 0 1 36 1 0 2 37 1 0 2 38 1 0 3 39 1 0 4 40 1 0 4 41 1 0 6 42 1 0 11 43 1 0 16 44 1 0 17 45 1 0 19 46 1 0 20 47 1 0 22 48 1 0 22 49 1 0 25 50 1 0 28 51 1 0 29 52 1 0 30 53 1 0 M CHG 1 3 1 M END