BGW02I -OEChem-04022100562D 42 44 0 1 0 0 0 0 0999 V2000 4.2690 -3.0784 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8055 1.4869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1515 0.3950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1552 2.5706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7577 3.9884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0812 -0.2737 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0812 -1.8832 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.0784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.5784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.0784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3435 0.9842 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3919 0.6768 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3452 1.9842 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3947 2.2949 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0873 3.2464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6648 -1.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -4.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8964 1.2647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7794 0.5809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2493 2.5967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7825 2.3929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7065 3.7357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5394 2.9563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7183 0.6462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7212 2.3174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2848 -1.0784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5672 4.5784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.9584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -4.5784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -5.1984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -4.5784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8469 -2.5415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2269 -3.6154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.3884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.5416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 21 1 0 0 0 0 2 12 1 0 0 0 0 2 14 1 0 0 0 0 11 3 1 1 0 0 0 3 30 1 0 0 0 0 13 4 1 1 0 0 0 4 31 1 0 0 0 0 5 15 1 0 0 0 0 5 33 1 0 0 0 0 12 6 1 6 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 17 2 0 0 0 0 7 18 1 0 0 0 0 8 16 1 0 0 0 0 8 20 2 0 0 0 0 9 19 2 0 0 0 0 9 20 1 0 0 0 0 10 20 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 6 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END $$$$