B3EPV4 -OEChem-04042105343D 36 39 0 0 0 0 0 0 0999 V2000 -4.5282 -2.1545 0.4859 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0427 -0.1765 -0.0751 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2432 1.6428 0.3616 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5904 1.6303 0.1886 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2824 -0.3513 -0.1949 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 -0.5874 -0.1186 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0263 1.1651 0.2153 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 0.5694 0.1578 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7483 1.7605 0.2996 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3636 1.0105 0.0976 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8851 -0.9114 -0.2753 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9595 -1.8228 -0.3658 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4846 0.5078 0.1933 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3571 -1.8650 -0.3263 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8504 1.0635 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1083 -0.7211 -0.0518 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0602 -0.2779 0.3413 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9037 1.8370 -0.4672 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3231 -0.8457 0.1734 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1666 1.2690 -0.6353 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3764 -0.0722 -0.3148 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8441 -2.6701 0.2898 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6861 2.8200 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9692 -1.9852 -0.5052 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3794 -2.7135 -0.5794 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0775 1.3918 0.4059 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5701 2.6429 0.2603 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8668 -2.8071 -0.5132 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1931 -0.7843 -0.0278 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2973 -0.9036 0.7915 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7536 2.8833 -0.7214 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 1.8721 -1.0158 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3817 -0.4490 -0.4695 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8263 -3.7234 0.5886 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1340 -2.6424 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5734 -2.1675 0.9341 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 22 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 11 1 0 0 0 0 3 7 2 0 0 0 0 3 8 1 0 0 0 0 4 10 1 0 0 0 0 4 15 1 0 0 0 0 4 27 1 0 0 0 0 5 10 1 0 0 0 0 5 11 2 0 0 0 0 6 8 1 0 0 0 0 6 12 2 0 0 0 0 7 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 11 24 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 13 16 1 0 0 0 0 13 26 1 0 0 0 0 14 16 2 0 0 0 0 14 28 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 29 1 0 0 0 0 17 19 1 0 0 0 0 17 30 1 0 0 0 0 18 20 2 0 0 0 0 18 31 1 0 0 0 0 19 21 2 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 M END $$$$