IFLAB-ZINC04315759 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0610 1.5020 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.0040 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -0.7010 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -2.0840 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.7780 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -2.0930 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -0.6980 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 0.0420 -2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 1.2550 -2.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -0.6280 -3.6250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 0.1050 -4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -0.8860 -6.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 0.0200 -7.5870 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -1.3250 -8.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -1.2200 -10.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -0.4000 -10.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -2.5070 -10.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -3.3410 -9.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -2.5960 -8.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 -2.8980 -11.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -4.2460 -12.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -4.6040 -13.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -3.6310 -14.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -2.2930 -14.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 -1.9210 -12.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -4.0910 -16.2230 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 1.8950 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 1.8510 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 1.8490 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -0.1660 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -2.6250 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -3.8570 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -2.6360 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -1.5970 -3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 0.7850 -4.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 0.6760 -5.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -1.5660 -6.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -1.4560 -5.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -4.4180 -9.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -5.0060 -11.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -5.6460 -13.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 -1.5390 -15.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -0.8770 -12.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END