IFLAB-ZINC04519149 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -0.6640 -1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -0.0460 -1.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.1590 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -2.7780 -0.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -2.8190 -2.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -4.2840 -2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 -4.7780 -3.3130 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3970 -4.4160 -4.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 -6.2840 -3.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -7.0730 -4.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -8.4090 -3.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -8.3570 -2.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -7.0670 -2.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 -4.1500 -3.3260 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 -2.7410 -3.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -4.7580 -2.2930 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 -4.7900 -4.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2270 -4.0650 -5.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7710 -4.5670 -7.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4080 -5.7950 -7.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 -6.5200 -5.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9610 -6.0140 -4.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0910 -6.4260 -8.6150 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -0.4990 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -2.3250 -2.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -4.6450 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -4.6610 -2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -6.7480 -5.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -9.3010 -4.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 -9.2080 -2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -3.1060 -5.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 -4.0000 -8.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 -7.4780 -5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 -6.5780 -3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 3 4 2 0 0 0 0 3 5 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 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 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 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 M END