B82EAW -OEChem-04012114392D 37 37 0 1 0 0 0 0 0999 V2000 4.6350 -4.4244 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6350 -4.4244 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.3856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.1144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.3856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.3856 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.6144 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 4.1144 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.6144 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.8856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.3856 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1350 0.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 -3.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 -3.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.8856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6874 -2.6041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -0.6956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5244 0.2221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 -0.4682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -2.9364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7596 -3.7255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5104 -3.7255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2540 -2.9364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7456 1.0068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3471 1.6970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -1.6956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6584 1.7221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0569 1.0318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 1.4244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.4244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9399 4.4244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.9944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 2 14 1 0 0 0 0 3 15 2 0 0 0 0 4 18 1 0 0 0 0 4 33 1 0 0 0 0 5 18 2 0 0 0 0 11 6 1 1 0 0 0 6 15 1 0 0 0 0 6 30 1 0 0 0 0 7 17 1 0 0 0 0 7 19 2 0 0 0 0 8 19 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 19 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 21 1 0 0 0 0 12 16 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 M END $$$$