BPVB72 -OEChem-04022102133D 36 38 0 0 0 0 0 0 0999 V2000 -1.2355 2.1707 -0.0032 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2255 2.2635 -1.0953 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 -2.2327 1.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0229 1.4385 0.8669 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1717 -1.3251 -0.8749 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7736 0.8591 -0.0009 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5549 0.4978 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6011 -0.8981 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5666 -0.2570 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7447 -1.3604 0.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0106 -0.1943 0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7074 1.2916 -0.0031 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8578 -1.5350 0.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9427 0.6377 -0.0028 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0192 -0.7537 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7345 -0.7691 -1.0424 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6804 0.4403 1.0484 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7977 -0.0742 0.0049 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1280 -0.7090 -1.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0738 0.5004 1.0498 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1503 1.4548 -0.0045 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3077 -1.4359 -0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2878 -0.0098 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0693 -2.3928 0.0039 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6365 2.3750 -0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9146 -2.6205 -0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2296 -1.2661 -1.8674 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1347 0.8881 1.8757 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6810 -1.1615 -1.8601 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5844 0.9949 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1988 2.3689 0.9484 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6441 0.8932 0.5133 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6826 0.0200 -1.0153 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7012 -0.8852 0.5167 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0404 2.8098 -1.0893 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3409 -2.6881 1.0798 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 31 1 0 0 0 0 2 21 1 0 0 0 0 2 35 1 0 0 0 0 3 22 1 0 0 0 0 3 36 1 0 0 0 0 4 21 2 0 0 0 0 5 22 2 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 10 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 24 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 22 1 0 0 0 0 16 19 1 0 0 0 0 16 27 1 0 0 0 0 17 20 2 0 0 0 0 17 28 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 23 32 1 0 0 0 0 23 33 1 0 0 0 0 23 34 1 0 0 0 0 M END $$$$