D0M2LD -OEChem-04152110062D 38 40 0 0 0 0 0 0 0999 V2000 4.6660 3.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -2.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 3.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.3103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 2.3797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0555 -0.5473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -1.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 0.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -0.3096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 2.9996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9951 -2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.5121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 2.1779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 -0.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -3.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5101 -3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -4.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7501 -3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 21 1 0 0 0 0 2 23 1 0 0 0 0 3 22 1 0 0 0 0 3 35 1 0 0 0 0 4 22 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 6 9 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 12 1 0 0 0 0 8 14 2 0 0 0 0 9 15 2 0 0 0 0 9 16 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 13 17 1 0 0 0 0 13 27 1 0 0 0 0 14 18 1 0 0 0 0 14 28 1 0 0 0 0 15 19 1 0 0 0 0 15 29 1 0 0 0 0 16 20 2 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 21 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 M END $$$$