BR4Y0D -OEChem-04022102022D 44 47 0 0 0 0 0 0 0999 V2000 2.5000 -2.1407 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 1.0618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -0.4382 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1168 -3.5964 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1994 -2.3940 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0303 -4.0032 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 2.0618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 2.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.0618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 3.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -0.9382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 -1.9328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 2.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 0.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2213 -2.6019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0747 2.0271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 4.0618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 3.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0747 4.0964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -0.5315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9808 2.5409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9808 3.5826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6994 -3.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2507 -4.0964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 -3.3645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5268 0.4791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9253 1.1694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 2.2518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9856 -0.7482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0675 1.4071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 4.6818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 3.8718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0675 4.7164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5402 0.0749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5165 2.2289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5165 3.8946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -1.2098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9407 -3.5595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7138 -4.4064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5607 -4.6334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6292 -3.9811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3106 -3.4294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7588 -2.7479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 23 1 0 0 0 0 2 14 2 0 0 0 0 3 11 1 0 0 0 0 3 14 1 0 0 0 0 3 30 1 0 0 0 0 4 6 1 0 0 0 0 4 15 1 0 0 0 0 4 25 1 0 0 0 0 5 15 2 0 0 0 0 5 24 1 0 0 0 0 6 24 2 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 8 10 1 0 0 0 0 8 16 2 0 0 0 0 9 14 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 17 1 0 0 0 0 10 19 2 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 15 1 0 0 0 0 13 18 1 0 0 0 0 13 29 1 0 0 0 0 16 21 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 19 22 1 0 0 0 0 19 34 1 0 0 0 0 20 23 2 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 24 26 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END $$$$