BN5QZ6 -OEChem-04012115262D 35 37 0 0 0 0 0 0 0999 V2000 6.3241 -3.2972 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5574 -0.3174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1660 3.2272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0320 1.7272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1660 0.2272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8981 3.2272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.8472 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 1.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 1.7272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4176 0.1926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 2.7272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 1.7064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1660 1.2272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 3.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 2.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5690 -1.3173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0320 2.7272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7088 -1.8273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4407 -1.8073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7204 -2.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4523 -2.8072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5921 -3.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8602 -3.3372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6364 -0.3875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0269 0.3073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9642 1.3943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4132 3.8818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9642 3.0601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1683 -1.5235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7030 -0.0828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6291 -0.0828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9741 -1.4911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5993 -3.9371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8981 3.8472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4350 2.9172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 10 1 0 0 0 0 2 16 1 0 0 0 0 3 11 1 0 0 0 0 3 17 2 0 0 0 0 4 13 2 0 0 0 0 4 17 1 0 0 0 0 5 13 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 17 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 23 3 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 14 2 0 0 0 0 12 15 2 0 0 0 0 12 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 16 18 1 0 0 0 0 16 19 2 0 0 0 0 18 20 2 0 0 0 0 18 29 1 0 0 0 0 19 21 1 0 0 0 0 19 32 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 22 33 1 0 0 0 0 M END $$$$