BX6E1G -OEChem-04012113012D 55 60 0 1 0 0 0 0 0999 V2000 2.1371 -1.2091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6938 -5.5769 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.6640 -4.1420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8622 1.0027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3346 -2.4065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7355 -0.6498 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3016 0.2512 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7647 -4.5794 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4339 2.0531 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2355 -2.8404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6876 -3.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1632 -4.0216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1417 -3.8778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1365 -2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -1.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7355 -0.6498 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9978 -4.4712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3590 -1.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0061 -2.9800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9362 -4.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3340 -1.2091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0141 -1.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6287 -0.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 1.0774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4311 1.9784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9890 -1.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6036 -0.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2838 -0.7640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9944 2.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5605 3.7056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5633 3.7803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1605 4.5571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 4.7117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7158 5.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6771 5.5769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -2.6962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1831 -3.5149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5882 -4.2533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3253 -4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1194 -0.5804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9491 -5.0893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5615 -2.7045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6834 0.2975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8314 -2.5346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2070 0.2010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4108 -2.1741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7864 0.5615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8883 -0.6261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6127 2.7583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3817 3.0004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7782 4.5036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4782 4.7509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 6.0100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4059 6.1344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 8 1 0 0 0 0 3 8 2 0 0 0 0 4 24 2 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 15 1 0 0 0 0 6 16 1 0 0 0 0 6 18 2 0 0 0 0 16 7 1 6 0 0 0 7 24 1 0 0 0 0 7 44 1 0 0 0 0 8 20 1 0 0 0 0 9 25 1 0 0 0 0 9 32 2 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 14 19 2 0 0 0 0 15 16 1 0 0 0 0 16 41 1 0 0 0 0 17 20 2 0 0 0 0 17 42 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 26 1 0 0 0 0 22 45 1 0 0 0 0 23 27 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 29 2 0 0 0 0 26 28 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 33 2 0 0 0 0 31 32 1 0 0 0 0 31 34 2 0 0 0 0 32 51 1 0 0 0 0 33 35 1 0 0 0 0 33 52 1 0 0 0 0 34 36 1 0 0 0 0 34 53 1 0 0 0 0 35 36 2 0 0 0 0 35 54 1 0 0 0 0 36 55 1 0 0 0 0 M CHG 2 2 -1 8 1 M END $$$$