BK50EM -OEChem-04012113042D 57 59 0 1 0 0 0 0 0999 V2000 11.3969 1.6651 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.0309 3.0311 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.6648 2.6651 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.0309 1.2990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0309 -0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0309 1.2990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0309 -0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0309 -0.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0309 1.2990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 -0.3717 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0309 1.2990 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.0309 -0.4330 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.5309 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5309 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5309 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5309 -1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5309 2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5309 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5309 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 1.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0309 -2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5309 -1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5309 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5309 -3.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0309 -2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5309 -3.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7209 0.7621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7209 -0.9699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9483 0.2210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6385 -0.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7209 -0.9699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7209 1.8360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6385 1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9483 0.6451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1399 1.8271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1399 -0.9610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4109 -2.1651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8409 -0.7621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.1870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2209 -3.5680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6509 -2.1651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8409 -3.5680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6509 1.2990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.3130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 19 1 0 0 0 0 3 19 1 0 0 0 0 4 16 2 0 0 0 0 5 21 2 0 0 0 0 6 30 1 0 0 0 0 6 54 1 0 0 0 0 7 30 2 0 0 0 0 8 14 1 0 0 0 0 8 16 1 0 0 0 0 8 40 1 0 0 0 0 9 13 1 0 0 0 0 9 21 1 0 0 0 0 9 41 1 0 0 0 0 10 20 1 0 0 0 0 10 23 1 0 0 0 0 10 45 1 0 0 0 0 11 35 1 0 0 0 0 11 55 1 0 0 0 0 11 56 1 0 0 0 0 12 35 2 0 0 0 0 12 57 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 13 36 1 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 17 30 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 25 2 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 24 2 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 23 28 1 0 0 0 0 24 44 1 0 0 0 0 25 32 1 0 0 0 0 25 46 1 0 0 0 0 26 33 2 0 0 0 0 26 47 1 0 0 0 0 27 29 2 0 0 0 0 27 48 1 0 0 0 0 28 31 2 0 0 0 0 28 49 1 0 0 0 0 29 31 1 0 0 0 0 29 35 1 0 0 0 0 31 50 1 0 0 0 0 32 34 2 0 0 0 0 32 51 1 0 0 0 0 33 34 1 0 0 0 0 33 52 1 0 0 0 0 34 53 1 0 0 0 0 M END $$$$