BP8Q0R -OEChem-04012118022D 44 47 0 0 0 0 0 0 0999 V2000 8.7576 0.6947 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -0.6947 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5177 0.9734 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9734 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3267 0.3857 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -0.3857 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0177 -0.5654 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 0.5654 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0177 -0.5654 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.5654 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5177 1.9734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7087 0.3857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -0.3857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0145 0.0255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3692 -0.0255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3837 2.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6517 2.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0634 0.3346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3203 -0.3346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3837 3.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6517 3.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5177 3.9734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.9734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7234 -0.5219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5031 -0.3562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6603 0.5219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8807 0.3562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9207 2.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1148 2.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9345 0.9410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4492 -0.9410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9207 3.7834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.7834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1148 3.7834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.7834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5177 4.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 15 1 0 0 0 0 2 14 1 0 0 0 0 2 16 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 3 13 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 4 14 1 0 0 0 0 5 9 2 0 0 0 0 6 10 2 0 0 0 0 7 9 1 0 0 0 0 7 13 2 0 0 0 0 8 10 1 0 0 0 0 8 14 2 0 0 0 0 11 17 2 0 0 0 0 11 19 1 0 0 0 0 12 18 2 0 0 0 0 12 20 1 0 0 0 0 15 21 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 22 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 23 1 0 0 0 0 17 33 1 0 0 0 0 18 24 1 0 0 0 0 18 34 1 0 0 0 0 19 25 2 0 0 0 0 19 35 1 0 0 0 0 20 26 2 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 23 27 2 0 0 0 0 23 39 1 0 0 0 0 24 28 2 0 0 0 0 24 40 1 0 0 0 0 25 27 1 0 0 0 0 25 41 1 0 0 0 0 26 28 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 M END $$$$