BC4Q3O -OEChem-04012115552D 39 42 0 0 0 0 0 0 0999 V2000 6.3758 -0.3489 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -4.0279 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.7666 3.6740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8110 4.0932 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4892 -1.8419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7094 -1.9321 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -1.4679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -3.2232 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.2385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3701 -0.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.4184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0405 0.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -1.2617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4036 1.9804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5763 -1.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7554 1.4481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0962 2.9320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1184 3.1416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4480 2.3996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7444 3.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6467 0.1569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0098 1.8505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3397 0.9880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6436 -2.5486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.8432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8418 2.5296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.4132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.0332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2048 4.2232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6144 2.8582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3506 3.3345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8743 4.0706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 15 1 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 3 20 1 0 0 0 0 3 26 1 0 0 0 0 4 22 1 0 0 0 0 4 36 1 0 0 0 0 5 17 2 0 0 0 0 6 15 1 0 0 0 0 6 17 1 0 0 0 0 6 31 1 0 0 0 0 7 13 1 0 0 0 0 7 15 2 0 0 0 0 8 13 2 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 18 2 0 0 0 0 10 14 1 0 0 0 0 10 16 2 0 0 0 0 10 19 1 0 0 0 0 11 14 2 0 0 0 0 11 17 1 0 0 0 0 12 21 2 0 0 0 0 14 27 1 0 0 0 0 16 20 1 0 0 0 0 16 28 1 0 0 0 0 18 24 1 0 0 0 0 18 29 1 0 0 0 0 19 23 2 0 0 0 0 19 30 1 0 0 0 0 20 22 2 0 0 0 0 21 25 1 0 0 0 0 21 32 1 0 0 0 0 22 23 1 0 0 0 0 23 33 1 0 0 0 0 24 25 2 0 0 0 0 24 34 1 0 0 0 0 25 35 1 0 0 0 0 26 37 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 M END $$$$