BNJR13 -OEChem-04022108132D 49 52 0 0 0 0 0 0 0999 V2000 10.0786 -2.0615 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3465 -2.0682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -1.5956 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4747 -0.5715 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8771 2.1518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3804 1.2877 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8106 -1.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8106 -2.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0288 -0.4722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0288 -2.7191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0539 -0.6947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0539 -2.4966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7046 -0.5610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7046 -2.6303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6106 -1.0748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6106 -2.1165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3427 -1.0682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2068 -0.5648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0747 -1.0615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9350 0.4418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2029 0.4352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9388 -0.5581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0670 0.9385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7991 0.9452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8998 1.9401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7142 0.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9465 -2.5581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5136 -0.0856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7598 0.0864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7598 -3.2777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5136 -3.1057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0539 -0.0747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4494 -0.5567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4494 -2.6346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0539 -3.1166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6974 0.0590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6974 -3.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1464 -2.4285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4724 0.0485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6648 0.7431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4769 -0.8661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0646 1.5585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4374 2.3532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8454 -0.0640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1271 2.7191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6386 -3.0963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4847 -2.8661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2545 -2.0200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 27 1 0 0 0 0 2 17 2 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 3 36 1 0 0 0 0 4 15 1 0 0 0 0 4 17 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 46 1 0 0 0 0 6 26 2 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 15 2 0 0 0 0 13 37 1 0 0 0 0 14 16 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 22 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 20 24 1 0 0 0 0 21 23 2 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M END $$$$