D02VQK -OEChem-10101305032D 36 38 0 0 0 0 0 0 0999 V2000 5.4791 1.5526 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -4.5352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -0.0352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -0.0352 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8611 1.5526 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 3.3126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 2.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -1.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 0.9648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -0.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -2.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -2.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 4.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 3.2081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1701 2.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -3.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -3.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -3.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 5.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 4.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -5.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 -0.3452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4011 -1.7252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 -1.7252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6056 4.2910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 2.6417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5345 3.0052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4011 -3.3452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 -3.3452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6534 5.6016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 3.9523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 5.4323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -4.4983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4011 -5.3452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -5.5722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 15 1 0 0 0 0 2 16 1 0 0 0 0 2 22 1 0 0 0 0 3 10 2 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 23 1 0 0 0 0 5 7 1 0 0 0 0 5 9 2 0 0 0 0 6 7 1 0 0 0 0 6 13 2 0 0 0 0 6 14 1 0 0 0 0 7 15 2 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 11 17 1 0 0 0 0 11 24 1 0 0 0 0 12 18 2 0 0 0 0 12 25 1 0 0 0 0 13 19 1 0 0 0 0 13 26 1 0 0 0 0 14 20 2 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 29 1 0 0 0 0 18 30 1 0 0 0 0 19 21 2 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 M END $$$$