BC1DT7 -OEChem-04012116332D 42 45 0 0 0 0 0 0 0999 V2000 5.5321 3.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -3.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 1.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 2.2247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.6692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 3.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1426 -1.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7441 -0.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1291 -1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -0.4646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 2.8446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.3571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 2.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.0700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1291 -2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -4.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 42 1 0 0 0 0 2 8 1 0 0 0 0 2 10 1 0 0 0 0 2 30 1 0 0 0 0 3 8 2 0 0 0 0 3 11 1 0 0 0 0 4 9 1 0 0 0 0 4 11 2 0 0 0 0 5 23 1 0 0 0 0 5 26 2 0 0 0 0 6 27 3 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 2 0 0 0 0 9 15 2 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 18 2 0 0 0 0 12 19 1 0 0 0 0 13 16 1 0 0 0 0 13 31 1 0 0 0 0 14 20 1 0 0 0 0 14 23 2 0 0 0 0 15 17 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 18 22 1 0 0 0 0 19 21 2 0 0 0 0 19 35 1 0 0 0 0 20 25 2 0 0 0 0 20 36 1 0 0 0 0 21 24 1 0 0 0 0 21 27 1 0 0 0 0 22 24 2 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 M END $$$$