BD85MN -OEChem-04012114322D 35 37 0 0 0 0 0 0 0999 V2000 5.5116 2.7088 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1753 3.3475 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9595 4.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 4.3180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 4.1101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 3.4520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.3018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -1.9921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.4256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.4256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.1944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.1944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 2.9256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.0744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.0744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.6944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.6944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.5044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9329 4.8844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 22 1 0 0 0 0 2 22 2 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 4 18 2 0 0 0 0 5 18 1 0 0 0 0 5 22 1 0 0 0 0 5 35 1 0 0 0 0 6 10 2 0 0 0 0 6 11 1 0 0 0 0 6 14 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 16 2 0 0 0 0 9 17 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 11 13 2 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 16 30 1 0 0 0 0 17 20 2 0 0 0 0 17 31 1 0 0 0 0 19 21 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 M END $$$$