BU4O7D -OEChem-04042102363D 31 34 0 0 0 0 0 0 0999 V2000 0.0521 2.6567 -0.2094 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3572 0.2598 0.3282 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9376 -1.8535 -0.2523 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7809 0.8306 -0.1074 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7012 0.0903 -0.4423 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7218 1.6649 0.4248 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8019 2.7136 0.3814 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0861 0.5436 0.1277 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6653 2.1659 0.0609 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2899 0.9350 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6873 0.5549 -0.8794 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6624 -0.7437 0.0642 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 -1.0883 0.2941 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6671 -0.1470 0.2355 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0633 -2.4887 0.1076 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7956 -2.9070 -0.2235 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2649 -0.2489 -1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3724 -0.4491 1.3923 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5941 -0.6609 -1.1068 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7017 -0.8612 1.2984 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3125 -0.9671 0.0488 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6279 -0.3310 -1.5239 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1612 1.3899 -1.4088 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7843 -0.4185 0.5629 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9387 -3.1148 0.2024 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3623 -3.8687 -0.4563 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7663 -0.0265 -1.9496 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8997 -0.3674 2.3667 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0710 -0.7435 -2.0793 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2612 -1.0996 2.1982 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3475 -1.2879 -0.0242 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 11 1 0 0 0 0 2 14 1 0 0 0 0 3 12 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 5 10 2 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 9 2 0 0 0 0 8 12 1 0 0 0 0 10 11 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 13 15 1 0 0 0 0 13 24 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 18 20 2 0 0 0 0 18 28 1 0 0 0 0 19 21 2 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 30 1 0 0 0 0 21 31 1 0 0 0 0 M END $$$$