IFLAB-ZINC03866505 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -2.5030 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -4.0100 2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -4.5900 1.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -4.7120 3.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -4.0110 4.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -6.1760 3.3130 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5280 -6.5240 2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 -6.7030 3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -8.2150 3.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -8.4780 4.6150 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -9.2990 3.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -8.8290 5.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -6.7440 4.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -2.1660 3.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -2.1400 2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -3.8520 5.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 -4.6110 4.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 -3.0480 4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -6.5300 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 -6.1880 4.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4150 -8.7830 2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 -8.5040 4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -6.2060 5.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -6.7080 4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -1.9800 1.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -2.3540 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 35 36 1 0 0 0 0 M END