RDKit 3D 49 53 0 0 0 0 0 0 0 0999 V2000 5.7979 2.8684 -0.9984 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0863 2.5076 -0.5403 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9739 1.2873 0.0893 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6563 0.8980 0.0371 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9346 1.8581 -0.6367 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1285 -0.3743 0.5594 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4217 -1.1798 -0.4610 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0466 -1.2189 -0.1649 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1028 -1.7713 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7641 -1.8421 -0.6155 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3792 -1.3822 0.6579 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3361 -0.8322 1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6554 -0.7707 1.0989 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0258 -0.1242 1.9953 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0341 -1.4364 1.1279 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4148 -0.6793 2.0119 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8577 -2.3762 0.5288 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1562 -2.6981 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1395 -1.5232 1.2474 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2736 -0.6550 0.0304 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9587 0.6443 -0.0891 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4090 1.6390 0.7801 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2237 2.8812 0.3013 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5722 3.2341 -1.0699 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0904 2.3582 -1.9513 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3096 0.9818 -1.4816 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7833 -0.0130 -2.1249 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.8257 -1.2018 -1.2564 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5563 4.1149 1.3017 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.5295 3.7712 -1.5322 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9999 3.0775 -0.6552 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7247 0.6738 0.5715 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 1.7512 -0.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9953 -0.9521 0.8996 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6198 -0.8697 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 -2.1523 -1.9939 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0381 -2.2504 -1.3117 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0566 -0.4642 2.5042 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3704 -3.1568 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5953 -3.4655 0.4553 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9837 -3.1542 2.0846 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8544 -0.9154 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1281 -1.9281 1.4988 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1364 1.3757 1.7985 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3931 4.2645 -1.3736 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 2.6513 -2.9646 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0801 0.0514 -3.0963 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 -1.9744 -1.7015 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8650 -1.5279 -1.1686 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 4 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 13 14 1 0 11 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 23 29 1 0 5 1 2 0 14 6 1 0 13 8 1 0 28 20 1 0 26 21 1 0 1 30 1 0 2 31 1 0 3 32 1 0 5 33 1 0 6 34 1 1 7 35 1 0 9 36 1 0 10 37 1 0 12 38 1 0 17 39 1 0 18 40 1 0 18 41 1 0 19 42 1 0 19 43 1 0 22 44 1 0 24 45 1 0 25 46 1 0 27 47 1 0 28 48 1 0 28 49 1 0 M CHG 1 27 1 M END