B5KR7M -OEChem-04022108132D 36 38 0 1 0 0 0 0 0999 V2000 7.2641 1.7379 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 3.2621 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7654 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.2621 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -3.2621 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.2379 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.2379 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 1.7379 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5320 0.7379 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6381 2.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 0.2033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.7587 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3981 2.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -0.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 2.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.7379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -2.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5386 2.5879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0427 2.7424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2445 2.7516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2445 -0.2758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0427 -0.2665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7356 2.3787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7966 2.7129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9995 2.7129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8656 1.6421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -0.4521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1291 -2.0721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -2.0721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 0.5479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.3821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 17 1 0 0 0 0 2 16 1 0 0 0 0 3 16 1 0 0 0 0 4 18 1 0 0 0 0 5 22 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 10 1 0 0 0 0 7 17 2 0 0 0 0 8 17 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 23 1 6 0 0 0 10 12 1 0 0 0 0 10 15 1 6 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 16 1 1 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 31 1 0 0 0 0 18 20 1 0 0 0 0 19 21 2 0 0 0 0 19 32 1 0 0 0 0 20 22 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 M END $$$$