BW42MI -OEChem-04012114272D 36 38 0 1 0 0 0 0 0999 V2000 4.1660 2.2868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.7521 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.1660 2.2868 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.2521 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5321 -0.7521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.7521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.2521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.7521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.7479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.2174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -2.2521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 1.3357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4751 1.3357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -2.2868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 1.0267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4261 1.0267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2030 0.0579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1426 -0.8598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7441 -0.1695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2675 -2.7270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0646 -2.7270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 0.4025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0881 -2.7890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -2.5621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7081 -1.7152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -2.9067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -0.4192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.0850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7144 1.6163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3163 0.8351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0976 0.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2345 0.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0158 0.8351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6177 1.6163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 12 1 0 0 0 0 2 5 1 0 0 0 0 2 7 1 0 0 0 0 2 11 1 0 0 0 0 3 13 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 19 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 8 1 0 0 0 0 6 10 2 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 14 2 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 15 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 14 16 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 M END $$$$