B1VS6R -OEChem-04012120132D 58 61 0 1 0 0 0 0 0999 V2000 2.8660 0.3766 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -0.4894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -0.4894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4460 2.5893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6732 1.3862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3118 1.1912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6397 1.6430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.8766 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4460 0.1639 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0846 -0.0310 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.8766 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7403 0.8725 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 2.3766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7403 1.8808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4124 0.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1181 -0.2878 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8573 -1.2532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5629 -1.9618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3454 0.9344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3021 -2.9272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5294 -1.7049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0078 -3.6357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2350 -2.4135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9742 -3.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5726 2.1566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5391 2.4135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2447 1.7049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7999 3.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2112 1.9618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7663 3.6357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4720 2.9272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9504 0.0551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5013 0.3004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 2.8516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 2.8516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 0.9843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 0.2940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 2.4592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 1.7690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2843 -0.4346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2798 0.3107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2959 -0.9900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5006 -1.7603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5220 -0.4703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7029 -3.0864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6911 -1.1064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8461 -4.2342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8343 -2.2542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4118 -3.8182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5198 2.7744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9551 2.2120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0830 1.1064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3624 3.8182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6487 1.5224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9280 4.2342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0712 3.0864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 11 1 0 0 0 0 1 15 1 0 0 0 0 4 14 2 0 0 0 0 5 17 2 0 0 0 0 6 21 1 0 0 0 0 6 27 1 0 0 0 0 7 21 2 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 12 9 1 1 0 0 0 9 17 1 0 0 0 0 9 42 1 0 0 0 0 18 10 1 1 0 0 0 10 21 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 1 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 13 16 1 0 0 0 0 13 36 1 0 0 0 0 13 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 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 22 24 1 0 0 0 0 22 47 1 0 0 0 0 23 25 2 0 0 0 0 23 48 1 0 0 0 0 24 26 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 29 31 1 0 0 0 0 29 54 1 0 0 0 0 30 32 2 0 0 0 0 30 55 1 0 0 0 0 31 33 2 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 58 1 0 0 0 0 M END $$$$