BH4QW3 -OEChem-04012113482D 47 50 0 1 0 0 0 0 0999 V2000 6.0554 1.6433 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.9003 0.4535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9003 -1.1560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0259 0.1488 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 10.4900 0.1488 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2463 0.2420 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 0.8807 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0772 1.8512 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2171 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7579 -1.8512 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7579 0.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8919 0.6488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6240 0.6488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3560 0.6488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2221 0.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0259 -0.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0881 0.6488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1599 0.6488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9541 0.1488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2221 -0.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9541 -0.8512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0881 -1.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4839 -0.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5772 0.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8919 -1.3512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0827 0.0146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9136 1.6238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1045 0.2225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3594 -0.3262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1565 -0.3262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2904 1.1237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4934 1.1237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0225 1.1237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2254 1.1237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7546 1.1237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9575 1.1237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4900 -0.4712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4153 -0.7436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8138 -1.4338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0881 1.2688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6851 -1.1612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0881 -1.9712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9448 -0.7659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9448 0.0635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3348 -0.5518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0424 2.2303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6438 -0.1923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 18 1 0 0 0 0 2 19 1 0 0 0 0 2 23 1 0 0 0 0 3 21 1 0 0 0 0 3 23 1 0 0 0 0 4 12 1 0 0 0 0 4 16 1 0 0 0 0 4 18 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 5 37 1 0 0 0 0 6 18 2 0 0 0 0 6 24 1 0 0 0 0 7 24 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 24 2 0 0 0 0 9 27 2 0 0 0 0 9 28 1 0 0 0 0 10 25 3 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 17 2 0 0 0 0 15 20 1 0 0 0 0 16 25 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 19 1 0 0 0 0 17 40 1 0 0 0 0 19 21 2 0 0 0 0 20 22 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 26 28 2 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 M END $$$$