RDKit 3D 22 21 0 0 0 0 0 0 0 0999 V2000 4.0993 0.5161 -0.2666 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9145 0.9458 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7614 0.0018 0.2849 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4689 0.6305 -0.7597 S 0 0 0 0 0 3 0 0 0 0 0 0 0.0488 2.1801 -0.2803 O 0 0 0 0 0 1 0 0 0 0 0 0 -0.9563 -0.3986 -0.7248 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -0.4456 0.6805 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9054 0.8712 1.1431 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6695 -1.3987 0.7514 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4405 -2.5763 0.3697 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9073 -1.0110 1.2087 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8996 1.2251 -0.3264 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2201 -0.5255 -0.5537 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7467 1.9569 0.4733 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4345 0.0010 1.3396 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0924 -0.9997 -0.0344 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7185 0.0527 -1.3881 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7611 -1.4128 -1.1054 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7576 -0.8356 1.3815 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0631 1.3036 1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2418 1.4070 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7411 -1.4881 0.9521 H 0 0 0 0 0 0 0 0 0 0 0 0 8 7 1 0 7 6 1 0 6 4 1 0 4 5 1 1 4 3 1 0 3 2 1 0 2 1 2 3 7 9 1 0 9 11 1 0 9 10 2 0 8 20 1 0 8 21 1 0 7 19 1 1 6 17 1 0 6 18 1 0 3 15 1 0 3 16 1 0 2 14 1 0 1 12 1 0 1 13 1 0 11 22 1 0 M CHG 2 4 1 5 -1 M END