B7HC8A -OEChem-04022100472D 53 57 0 0 0 0 0 0 0999 V2000 8.4013 -1.2972 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0214 1.2705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6614 3.1653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3024 2.6111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3046 -2.5129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 -3.4994 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8311 -3.4985 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6624 0.7163 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 -1.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 -1.9670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 -1.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 -2.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 -1.9670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1391 -2.5534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 -0.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 -2.1992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0907 -2.2460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 -0.4399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8987 -2.8352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4013 -1.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7087 -2.2488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0019 1.4671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3219 2.4145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6592 -2.5594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6097 -2.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5603 -3.1808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9814 4.1128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2551 -2.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4613 -3.8021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9994 -2.1557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4118 -4.1128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9499 -2.4664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1561 -3.4449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6338 -0.8870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9626 -0.3993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4734 -4.0016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5182 -2.7910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 0.0225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -1.5618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2703 0.8381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8976 -3.4552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0378 -0.7932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2682 -3.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0482 -3.5633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5688 3.9144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1798 4.7002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 4.3111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9998 -4.2162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8715 -1.5491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5397 -4.7194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4114 -2.0523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7455 -3.6375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 23 2 0 0 0 0 3 24 1 0 0 0 0 3 28 1 0 0 0 0 4 24 2 0 0 0 0 5 27 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 37 1 0 0 0 0 7 14 2 0 0 0 0 8 15 1 0 0 0 0 8 23 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 12 2 0 0 0 0 10 14 1 0 0 0 0 11 13 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 16 1 0 0 0 0 14 17 1 0 0 0 0 15 18 2 0 0 0 0 16 19 2 0 0 0 0 16 38 1 0 0 0 0 17 20 1 0 0 0 0 17 21 2 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 22 2 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 25 26 3 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 30 32 1 0 0 0 0 30 49 1 0 0 0 0 31 33 2 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 $$$$