IFLAB-ZINC02699752 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 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 1.2180 -0.6610 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 0.0150 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3700 1.3340 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 2.0590 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 -0.7180 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0470 -0.9650 -1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 -1.6800 -1.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7720 -1.9620 -2.7970 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5880 -1.1520 -3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0170 -0.0810 -3.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8760 -1.7860 -4.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6340 -1.4280 -5.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6940 -2.2750 -6.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0040 -3.4720 -6.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2410 -3.8420 -5.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1710 -3.0060 -4.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 -3.0760 -3.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 -3.9860 -3.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 1.9220 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -0.5640 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -1.7410 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 1.8530 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 3.1380 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 -0.1310 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 -1.6720 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 -1.5520 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 -0.0100 -1.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1760 -0.4940 -5.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2850 -1.9970 -7.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0580 -4.1230 -7.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7030 -4.7790 -5.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 13 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 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 M CHG 1 4 1 M END