B3U9NE -OEChem-04012117442D 45 47 0 0 0 0 0 0 0999 V2000 4.5411 -1.7306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -4.7306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 6.2694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 -5.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -6.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -6.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -3.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -3.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -2.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 -0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 -0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 3.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 3.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 4.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 5.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -4.7814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4336 -5.5705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1844 -5.5705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 -4.7814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7026 -6.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3738 -6.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2442 -6.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9155 -6.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -3.1480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1984 -3.8382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8871 -3.8132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2856 -3.1229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -1.6480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0645 -2.3382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 -0.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1381 -0.5406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 1.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1381 1.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 2.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1381 2.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 4.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1381 4.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 2 8 1 0 0 0 0 3 23 3 0 0 0 0 4 6 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 7 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 15 1 0 0 0 0 12 38 1 0 0 0 0 13 16 2 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 42 1 0 0 0 0 19 21 2 0 0 0 0 19 43 1 0 0 0 0 20 22 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 M END $$$$