B7QOW5 -OEChem-04012119422D 42 43 0 0 0 0 0 0 0999 V2000 6.8671 2.5600 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3671 3.4260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3671 1.6940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 4.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 4.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 -1.8574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 -2.5477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -2.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 -1.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 -4.0226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0135 -3.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4231 -1.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 -1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0431 -0.4031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 5.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 4.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 5 1 0 0 0 0 1 15 1 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 6 16 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 10 1 0 0 0 0 8 14 2 0 0 0 0 9 11 2 0 0 0 0 9 14 1 0 0 0 0 9 17 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 16 1 0 0 0 0 13 26 1 0 0 0 0 13 27 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 16 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 20 1 0 0 0 0 18 36 1 0 0 0 0 19 21 2 0 0 0 0 19 37 1 0 0 0 0 20 22 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END $$$$