IFLAB-ZINC04519148 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 2.9470 -4.4000 -3.3210 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 3.0460 -7.0560 -3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 -8.3990 -3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -8.3680 -3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -7.0850 -3.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -4.1770 -4.7830 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -4.7180 -4.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -2.7860 -4.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -4.9340 -6.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -6.1660 -6.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -6.7610 -7.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 -6.1230 -8.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -4.8890 -7.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 -4.2930 -6.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 -6.8690 -9.5900 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 4.0710 -6.7150 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 -9.2810 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -9.2290 -3.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -6.6650 -6.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -7.7240 -8.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -4.3910 -8.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -3.3280 -6.3680 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