BM5NT9 -OEChem-04022105462D 48 51 0 0 0 0 0 0 0999 V2000 10.4030 -0.4862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.0204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.5204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2632 1.0171 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9914 2.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1234 2.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9952 1.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2593 2.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1311 0.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3991 0.5138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5312 1.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 0.5071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7991 1.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 0.5004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5273 2.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.4796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7953 2.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 1.0143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6594 2.5071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -0.5412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 -1.0551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.4796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6024 1.9184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2012 2.6072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5201 2.9969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7231 2.9938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2095 0.4420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6054 1.1338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0450 2.5989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6492 1.9071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7344 0.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5315 0.0470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6694 -0.1129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0630 2.3225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0218 1.6342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2571 2.3117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6570 3.1271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4708 -0.8533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0218 -1.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.5996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.7896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -2.3304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 25 1 0 0 0 0 2 48 1 0 0 0 0 3 27 2 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 8 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 9 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 19 2 0 0 0 0 14 21 1 0 0 0 0 15 20 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 16 24 1 0 0 0 0 17 22 1 0 0 0 0 17 23 1 0 0 0 0 18 20 2 0 0 0 0 18 41 1 0 0 0 0 19 40 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 25 2 0 0 0 0 23 27 1 0 0 0 0 24 26 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 M END $$$$