Marvin 10200914122D 17 12 0 0 0 0 999 V2000 -2.7795 0.1080 0.0000 Fe 0 1 0 0 0 0 0 0 0 0 0 0 -0.6850 0.1080 0.0000 Fe 0 1 0 0 0 0 0 0 0 0 0 0 -3.9482 2.0085 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3649 2.5918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5316 1.4251 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.5316 2.5918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3649 1.4251 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8071 2.0232 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2238 2.6066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3905 1.4399 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3905 2.6066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2238 1.4399 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4518 2.0429 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0351 2.6262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1316 1.4595 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1316 2.6262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0351 1.4595 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 3 6 2 0 0 0 0 3 7 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 M CHG 8 1 3 2 3 5 -1 7 -1 10 -1 12 -1 15 -1 17 -1 M END