B3RCY5 -OEChem-04012112383D 26 27 0 1 0 0 0 0 0999 V2000 -4.5093 -0.9282 0.4247 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 1.2092 0.7079 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.9097 0.3148 -1.2669 F 0 0 0 0 0 0 0 0 0 0 0 0 5.0182 0.7537 -0.0031 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5554 -1.3913 0.0596 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8628 -1.3832 -0.3312 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1923 -0.1908 0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2851 -0.1620 0.3674 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4040 1.0245 -0.0577 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0678 0.6983 -0.0109 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4967 -0.6404 0.0109 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -1.7655 0.0777 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7532 0.1151 0.0506 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0156 1.7292 -0.0486 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8684 -0.9255 0.0318 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8044 0.1082 0.0046 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3784 1.4340 -0.0377 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1987 -0.3196 1.4508 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6105 1.8761 0.6025 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6446 1.3327 -1.0835 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1794 -2.5867 -0.5709 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5335 -2.1538 1.1032 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8789 -1.2191 -1.3382 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6953 2.7673 -0.0863 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1776 -1.9679 0.0703 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0794 2.2644 -0.0638 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 2 13 1 0 0 0 0 3 13 1 0 0 0 0 4 7 1 0 0 0 0 5 7 2 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 23 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 21 1 0 0 0 0 12 22 1 0 0 0 0 14 17 2 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 17 26 1 0 0 0 0 M CHG 2 4 -1 7 1 M END $$$$