D0K3ES -OEChem-10191522232D 45 47 0 1 0 0 0 0 0999 V2000 6.0010 2.4400 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -5.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.0600 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2690 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 4.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -3.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -4.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 5.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.3200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 2.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 5.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 21 1 0 0 0 0 2 7 1 0 0 0 0 2 35 1 0 0 0 0 3 19 2 0 0 0 0 3 20 1 0 0 0 0 4 18 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 22 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 24 3 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 8 10 2 0 0 0 0 8 12 1 0 0 0 0 9 16 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 13 2 0 0 0 0 11 15 1 0 0 0 0 12 14 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 15 18 2 0 0 0 0 15 24 1 0 0 0 0 16 19 1 0 0 0 0 16 33 1 0 0 0 0 17 20 2 0 0 0 0 17 34 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 25 2 0 0 0 0 23 26 1 0 0 0 0 23 38 1 0 0 0 0 25 27 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 M END $$$$