BDJQ37 -OEChem-04022109072D 43 45 0 1 0 0 0 0 0999 V2000 5.4791 2.3026 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -5.2852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 0.7148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -0.7852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 0.7148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8611 2.3026 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 5.6807 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -1.2852 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9380 -2.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -0.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -2.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -2.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -3.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -3.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 0.2148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -4.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 1.7148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 3.2536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 4.0626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1701 3.2536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 3.9581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 4.9762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -5.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 5.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 -1.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -0.2483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5351 -0.4752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -1.3222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 -1.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 -2.4752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5351 -2.4752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 -4.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5351 -4.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 0.4048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5345 3.7552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 3.3917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6056 5.0410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -5.2483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5351 -6.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -6.3222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 4.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6534 6.3516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 20 1 0 0 0 0 2 16 1 0 0 0 0 2 23 1 0 0 0 0 3 15 2 0 0 0 0 8 4 1 1 0 0 0 4 15 1 0 0 0 0 4 30 1 0 0 0 0 5 15 1 0 0 0 0 5 17 1 0 0 0 0 5 35 1 0 0 0 0 6 17 2 0 0 0 0 6 18 1 0 0 0 0 7 24 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 12 14 2 0 0 0 0 12 32 1 0 0 0 0 13 16 2 0 0 0 0 13 33 1 0 0 0 0 14 16 1 0 0 0 0 14 34 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 36 1 0 0 0 0 21 24 1 0 0 0 0 21 37 1 0 0 0 0 22 25 2 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$