D0A5TD -OEChem-10101305022D 46 50 0 1 0 0 0 0 0999 V2000 5.5073 2.0150 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2631 3.6542 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.5073 -0.2320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5324 1.7925 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0985 0.8915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5324 -0.0095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9089 2.5743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9089 -0.7913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2892 1.3915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2892 0.3915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2742 -1.7222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6508 -2.5040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9201 -0.6423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6619 -2.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2742 3.5052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9201 2.4253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2966 -1.4241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1831 1.9262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1831 -0.1432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0462 -3.4676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6508 4.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2966 3.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0892 1.4123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0892 0.3707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6619 4.1380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4031 -4.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3731 -4.1318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9163 1.7230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6138 1.2781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6138 0.5049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8873 -1.8146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6936 -0.0651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6936 1.8481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6835 -1.3317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1759 2.5461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1759 -0.7631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6603 -3.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8773 4.8642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6835 3.1147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -3.0597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6249 1.7244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6249 0.0586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2754 4.6227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6318 -4.8633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9846 -4.6150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 9 1 0 0 0 0 2 15 1 0 0 0 0 3 6 2 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 8 1 0 0 0 0 7 15 1 0 0 0 0 7 16 2 0 0 0 0 8 11 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 19 2 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 20 2 0 0 0 0 13 17 2 0 0 0 0 13 33 1 0 0 0 0 14 17 1 0 0 0 0 14 23 2 0 0 0 0 15 21 2 0 0 0 0 16 22 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 18 24 1 0 0 0 0 18 36 1 0 0 0 0 19 25 1 0 0 0 0 19 37 1 0 0 0 0 20 27 1 0 0 0 0 20 38 1 0 0 0 0 21 26 1 0 0 0 0 21 39 1 0 0 0 0 22 26 2 0 0 0 0 22 40 1 0 0 0 0 23 28 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 M END $$$$