BTJB95 -OEChem-04012114003D 30 31 0 0 0 0 0 0 0999 V2000 1.9463 0.9066 3.1576 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.1601 -1.8565 -0.9155 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.2928 -2.4908 0.3241 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6977 0.9456 -0.7831 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3441 0.9618 -0.7829 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8691 1.6706 -1.7336 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5951 -0.4420 -0.6837 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4849 1.6820 -1.7392 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5957 1.6386 0.0288 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3906 -1.1365 0.2277 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2348 0.0109 -1.2541 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2439 1.2481 0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3911 0.9441 0.9402 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2885 -0.4434 1.0396 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0562 0.5650 1.4743 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0473 -0.6722 -0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 -0.3952 1.0152 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -3.1368 -0.5354 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4003 2.2581 -2.4781 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8972 -0.9416 -1.3479 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 2.2440 -2.5107 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6864 2.7202 -0.0363 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3017 -0.2045 -2.3181 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5532 2.0060 0.9316 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0900 1.4836 1.5726 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9109 -0.9789 1.7513 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5914 -0.9281 1.7211 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3285 -2.8172 -0.3248 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6221 -3.0106 -1.5901 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4052 -4.2091 -0.3201 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 16 1 0 0 0 0 3 10 1 0 0 0 0 3 18 1 0 0 0 0 4 6 1 0 0 0 0 4 7 2 0 0 0 0 4 9 1 0 0 0 0 5 8 1 0 0 0 0 5 11 2 0 0 0 0 5 12 1 0 0 0 0 6 8 2 0 0 0 0 6 19 1 0 0 0 0 7 10 1 0 0 0 0 7 20 1 0 0 0 0 8 21 1 0 0 0 0 9 13 2 0 0 0 0 9 22 1 0 0 0 0 10 14 2 0 0 0 0 11 16 1 0 0 0 0 11 23 1 0 0 0 0 12 15 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 15 17 1 0 0 0 0 16 17 2 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 M END $$$$