OTAVA-ZINC00124507 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.7290 1.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.0660 0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.0840 1.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -4.3930 1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -4.7590 0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -3.7720 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -2.4310 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.9560 -1.4140 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -6.0800 -0.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -6.9050 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -8.3250 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -9.2140 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 -10.5430 0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -11.0040 -0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -10.1380 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -8.7980 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -11.4830 0.9690 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4720 -11.0810 1.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 -12.6590 0.6510 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.8190 2.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -5.1590 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -4.0480 -1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -6.5450 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 -8.8590 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -12.0480 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -10.5050 -2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -7.9460 -1.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -7.5290 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 32 33 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END