BBJ2Z9 -OEChem-04012120082D 55 60 0 1 0 0 0 0 0999 V2000 3.8000 0.5173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6073 1.9892 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0011 1.1844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 -0.9827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -3.9827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.9827 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6660 -1.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -2.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -3.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -3.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -1.9480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -1.9480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -4.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -4.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -2.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -3.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5960 2.0922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 3.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 3.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 4.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.3627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9951 0.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4188 -1.3280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -1.3280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 -0.7927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4188 -4.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -4.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 -2.1498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.1498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 -3.8156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -3.8156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1856 2.2840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4673 2.6987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3234 1.1250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7219 0.4347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3369 2.2073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 2.2073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3369 3.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 3.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 4.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 28 1 0 0 0 0 2 18 1 0 0 0 0 2 27 1 0 0 0 0 3 19 1 0 0 0 0 3 27 1 0 0 0 0 4 13 2 0 0 0 0 5 11 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 6 35 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 10 12 1 0 0 0 0 10 17 2 0 0 0 0 11 21 1 0 0 0 0 12 22 2 0 0 0 0 14 18 1 0 0 0 0 14 36 1 0 0 0 0 15 20 2 0 0 0 0 15 37 1 0 0 0 0 16 23 2 0 0 0 0 16 38 1 0 0 0 0 17 24 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 40 1 0 0 0 0 21 25 2 0 0 0 0 21 41 1 0 0 0 0 22 26 1 0 0 0 0 22 42 1 0 0 0 0 23 25 1 0 0 0 0 23 43 1 0 0 0 0 24 26 2 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 30 32 1 0 0 0 0 30 51 1 0 0 0 0 31 33 2 0 0 0 0 31 52 1 0 0 0 0 32 34 2 0 0 0 0 32 53 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 34 55 1 0 0 0 0 M END $$$$