BB92PU -OEChem-04022102432D 38 42 0 0 0 0 0 0 0999 V2000 2.5836 0.8268 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.4779 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -1.9779 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1562 3.5613 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9598 2.1569 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1352 3.7654 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 1.0221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 0.5221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 -0.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.5221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -0.9779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3798 2.0636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1719 1.0289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1799 2.0705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 -0.7827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2778 2.5913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0479 2.5672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -2.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -3.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -1.9779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -3.9779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 -2.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 -3.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6318 2.8975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8393 2.3674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7052 0.7127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -1.3720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2754 3.2113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8589 -2.2879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 0.0221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7249 -3.7879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -1.3579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6971 3.9779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -4.5979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5309 -2.1679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5309 -3.7879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2482 2.8303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 17 1 0 0 0 0 2 10 1 0 0 0 0 2 11 2 0 0 0 0 3 11 1 0 0 0 0 3 19 1 0 0 0 0 3 30 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 4 34 1 0 0 0 0 5 18 2 0 0 0 0 5 25 1 0 0 0 0 6 25 2 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 10 13 1 0 0 0 0 12 16 2 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 15 17 2 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 17 31 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 21 23 2 0 0 0 0 21 33 1 0 0 0 0 22 24 2 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 M END $$$$