B2U5PI -OEChem-04012112422D 35 37 0 0 0 0 0 0 0999 V2000 5.5443 -1.4915 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3133 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 1.0685 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1867 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5013 0.5304 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1441 2.2253 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 0.1180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.1867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -0.6867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8335 1.2747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4798 0.7367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1477 -0.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8370 -0.9582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1262 0.1986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5048 -1.7025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7940 -0.5457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4833 -1.4962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7479 -0.6867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4409 1.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.4967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0062 1.0643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2486 1.3119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2303 -1.0860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3188 0.7879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3122 -2.2918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4007 -0.4179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7508 2.3531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7301 2.6867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8974 -1.9577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 13 2 0 0 0 0 3 14 2 0 0 0 0 4 9 1 0 0 0 0 4 14 1 0 0 0 0 4 23 1 0 0 0 0 5 10 1 0 0 0 0 5 15 1 0 0 0 0 5 25 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 6 26 1 0 0 0 0 7 15 2 0 0 0 0 7 16 1 0 0 0 0 8 15 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 12 2 0 0 0 0 11 13 1 0 0 0 0 12 24 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 19 21 2 0 0 0 0 19 30 1 0 0 0 0 20 22 2 0 0 0 0 20 31 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 22 35 1 0 0 0 0 M END $$$$