RDKit 3D 50 52 0 0 0 0 0 0 0 0999 V2000 4.1307 -0.5798 -1.2285 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0622 0.2859 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6468 1.5636 -0.2671 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3277 2.0071 -0.4291 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4187 1.1269 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7979 -0.1761 -1.4109 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7685 -1.1353 -1.9784 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1792 -2.2820 -2.3314 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5683 -0.7207 -2.0351 O 0 0 0 0 0 1 0 0 0 0 0 0 2.9919 3.2321 0.0875 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7826 3.8413 -0.3555 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4891 3.3741 0.3289 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6096 3.7498 -0.0706 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 2.5314 1.3986 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1639 1.5556 1.9205 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3947 1.2597 1.3293 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1495 0.1799 1.8027 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7259 -0.5728 2.9019 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -0.2652 3.5135 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2683 0.7819 3.0164 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7922 1.0923 3.7800 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.6626 -0.2729 0.9891 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0125 0.7467 0.0241 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6012 -0.6548 2.0267 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2293 -1.6809 0.1407 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1769 -1.5176 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7909 -1.5642 -2.3385 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5423 -2.7613 -2.6219 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9818 -3.4400 -1.4423 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4039 -2.4668 -0.3424 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6381 2.4383 0.3289 N 0 0 0 0 0 4 0 0 0 0 0 0 6.2370 2.0150 1.3295 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8507 3.5301 -0.2194 O 0 0 0 0 0 1 0 0 0 0 0 0 4.4265 -1.5857 -1.5267 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 -0.0440 -0.5218 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3753 1.3911 -1.1809 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6734 3.7459 -1.4428 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8758 4.9111 -0.1362 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6672 2.4918 1.7516 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7503 1.8067 0.4602 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3235 -1.4073 3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -0.8589 4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4607 -2.3370 -0.8029 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6343 -0.5802 -0.8044 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4718 -0.7172 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0092 -1.4832 -3.0999 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1767 -4.1012 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8272 -4.0740 -1.7276 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8203 -3.0259 0.5018 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1692 -1.7872 -0.7355 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 7 9 1 0 4 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 17 22 1 0 22 23 2 0 22 24 2 0 22 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 3 31 1 0 31 32 2 0 31 33 1 0 6 1 1 0 20 15 1 0 30 25 1 0 1 34 1 0 2 35 1 0 5 36 1 0 11 37 1 0 11 38 1 0 14 39 1 0 16 40 1 0 18 41 1 0 19 42 1 0 26 43 1 0 26 44 1 0 27 45 1 0 27 46 1 0 29 47 1 0 29 48 1 0 30 49 1 0 30 50 1 0 M CHG 3 9 -1 31 1 33 -1 M END