B3S9HV -OEChem-04012112453D 31 33 0 1 0 0 0 0 0999 V2000 -3.0263 -3.1399 0.5356 I 0 0 0 0 0 0 0 0 0 0 0 0 3.3909 1.4447 1.2708 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5729 -1.6633 -0.8014 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4915 2.7170 -0.4869 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7597 -0.4954 -0.1788 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8319 0.5363 0.0199 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1067 1.0968 -0.3291 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -0.3157 -0.2014 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3838 0.0272 -0.8655 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6707 0.5554 -1.4298 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5692 0.8430 0.1032 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6532 0.2325 1.1988 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1637 0.4831 1.4756 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2181 -1.7015 -0.3521 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7793 1.5362 -0.2797 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2353 -0.7737 0.2427 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5071 -1.1883 0.1946 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5707 -0.1944 -0.1166 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8558 -0.7161 -1.4451 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9975 0.1428 -2.3774 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8839 1.6126 -1.3276 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7349 1.9089 -0.0944 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 -0.4509 1.9488 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 1.2914 2.1966 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7337 -0.4289 1.9024 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6443 -2.2884 -1.0783 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1928 -2.2540 0.5925 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3184 1.2326 1.0692 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5714 -1.3536 -1.7226 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4464 -1.4894 0.4524 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8074 1.8009 -0.5437 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 12 1 0 0 0 0 2 28 1 0 0 0 0 3 14 1 0 0 0 0 3 29 1 0 0 0 0 4 15 2 0 0 0 0 5 18 2 0 0 0 0 6 11 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 15 1 0 0 0 0 7 18 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 M END $$$$