B8D2CM -OEChem-04012114432D 28 29 0 0 0 0 0 0 0999 V2000 2.3109 1.8394 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1588 -0.2296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 3.5620 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0852 2.8575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8628 -3.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8987 1.0304 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5896 0.0794 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1307 -3.5084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3987 -0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2077 0.0794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8987 1.0304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4865 1.8394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3987 -1.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2647 -2.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2647 -3.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1307 -1.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0797 2.7530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9967 -2.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9967 -3.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9172 1.3935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0005 2.1862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8617 -1.8184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7278 -3.3184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1307 -0.8884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1307 -4.1284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5337 -1.6984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4153 4.1284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 10 2 0 0 0 0 3 17 1 0 0 0 0 3 28 1 0 0 0 0 4 17 2 0 0 0 0 5 19 2 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 22 1 0 0 0 0 8 15 1 0 0 0 0 8 19 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 12 17 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 24 1 0 0 0 0 16 18 2 0 0 0 0 16 25 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 M END $$$$