B53PFR -OEChem-04012118512D 39 42 0 0 0 0 0 0 0999 V2000 4.6660 1.7329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.2671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4144 1.7675 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0641 0.2604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.7329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 0.7676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 0.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -0.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.7676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 0.7571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9282 0.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7961 0.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9243 1.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6602 0.7704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7884 2.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6564 1.7704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4188 -1.9217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8678 -1.1000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 1.3875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -1.9217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.5658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.1000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1938 1.3771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9478 2.0837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 2.0713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7985 -0.3529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3862 2.0717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1984 0.4625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7860 2.8871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1921 2.0825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 2 11 2 0 0 0 0 3 10 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 19 2 0 0 0 0 4 20 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 11 1 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 2 0 0 0 0 8 11 1 0 0 0 0 8 16 2 0 0 0 0 10 12 2 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 15 17 1 0 0 0 0 15 28 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 35 1 0 0 0 0 22 24 2 0 0 0 0 22 36 1 0 0 0 0 23 25 2 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M END $$$$