IFLAB-ZINC04519405 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 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 0.8790 -0.6050 1.4720 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -0.2900 1.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.3250 2.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -2.2550 1.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -2.9220 0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -4.4170 0.5360 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2040 -4.5590 1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 -5.1040 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5110 -5.7880 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 -6.2600 -1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 -5.8360 -2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -5.1410 -1.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -5.1290 0.7240 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -4.6370 1.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -5.1310 -0.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -6.8340 1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -7.2630 2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -8.6000 2.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -9.5090 1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -9.0780 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -7.7420 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -11.1880 1.9320 Cl 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 0.3380 -2.7790 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -2.7810 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -2.4950 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 -5.9460 0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 -6.8480 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -6.0260 -3.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -6.5540 3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -8.9350 3.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -9.7870 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -7.4060 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 M END