PUBCHEM-ZINC01128799 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -0.0310 1.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 0.0120 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -0.4920 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -1.8430 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -2.6660 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -4.0400 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 -4.5970 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 -3.7830 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 -2.4040 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 -1.5770 0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 -1.2360 1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -0.0490 1.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 0.4610 1.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 0.4450 3.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 1.4710 3.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 1.6390 3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 2.6530 4.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 3.5020 4.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 3.3370 5.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 2.3280 4.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6290 2.1530 4.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 4.7760 5.7390 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.5090 -0.9850 -1.3680 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2330 0.1900 -1.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -0.9980 -2.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -2.1520 -1.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0190 -2.0400 -1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9500 -2.9540 -2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5570 -3.9820 -2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2330 -4.0930 -3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 -3.1750 -2.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7260 -5.1310 -3.4290 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 1.9260 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 1.8960 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.8940 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3400 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -0.3420 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -2.2340 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -4.6800 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -5.6710 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8970 -4.2210 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5770 -0.9910 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 -2.0860 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0430 0.0890 3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 0.9760 2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 2.7830 3.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 4.0010 5.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7510 1.4790 5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0690 3.1210 5.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1280 1.7330 4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3250 -1.2380 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9840 -2.8670 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 -4.8950 -3.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 -3.2590 -3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 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 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 M END