BNHJ12 -OEChem-04012116532D 46 49 0 1 0 0 0 0 0999 V2000 10.7671 -0.1034 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 7.3435 0.6702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8055 1.1746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0873 2.9324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.3924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2656 -0.9703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6340 0.3951 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.9003 -0.6019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0812 -0.5877 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0812 -2.1972 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0681 1.8482 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.3925 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9350 2.3467 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.8924 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6770 1.6763 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.3925 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3919 0.3628 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8055 1.1728 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3947 1.9808 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3452 1.6702 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1552 2.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.8925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6648 -1.3924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.3925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3919 -3.1477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2743 0.8697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.8925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2686 0.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7794 0.2669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 1.7257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7825 2.0789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8972 1.3877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5028 2.7700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7100 2.6880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2848 -1.3924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4964 1.7120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5030 3.3924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8026 -3.3403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5845 -3.7370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9812 -2.9551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8587 0.4097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.2275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8856 -0.9714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 8 2 0 0 0 0 1 29 1 0 0 0 0 2 17 1 0 0 0 0 2 20 1 0 0 0 0 18 3 1 6 0 0 0 3 37 1 0 0 0 0 19 4 1 6 0 0 0 4 38 1 0 0 0 0 5 25 2 0 0 0 0 6 46 1 0 0 0 0 17 9 1 1 0 0 0 9 22 1 0 0 0 0 9 23 2 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 10 26 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 11 27 1 0 0 0 0 12 22 1 0 0 0 0 12 28 2 0 0 0 0 13 15 2 0 0 0 0 14 25 1 0 0 0 0 14 28 1 0 0 0 0 14 43 1 0 0 0 0 15 29 1 0 0 0 0 16 28 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 1 1 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 24 2 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 27 29 2 0 0 0 0 27 42 1 0 0 0 0 M CHG 2 7 -1 9 1 M END $$$$