B1CWQ4 -OEChem-04012114332D 31 34 0 0 0 0 0 0 0999 V2000 8.1118 -1.3159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3829 -2.2831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 1.7553 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.2138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.7138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.2138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4421 0.7207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.2862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3903 -1.2831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2814 0.1924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2558 -0.7989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4501 1.7623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.7485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -1.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 2.2831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9875 -0.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.9062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8280 0.4851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9882 2.0702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 1.3684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -1.9408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5456 2.9031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.5467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2868 -1.3760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5304 -0.5337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6881 -0.2901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 20 1 0 0 0 0 2 11 2 0 0 0 0 3 6 2 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 2 0 0 0 0 5 10 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 7 9 1 0 0 0 0 7 15 2 0 0 0 0 8 12 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 21 1 0 0 0 0 11 13 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 14 17 2 0 0 0 0 14 23 1 0 0 0 0 15 18 1 0 0 0 0 15 24 1 0 0 0 0 16 19 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 20 29 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 M END $$$$