IFLAB-ZINC04337472 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 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 0.0230 -0.6880 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.0380 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7200 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.9380 -0.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0100 -1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6640 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0370 -2.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.7040 -2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.9390 2.6930 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -3.9810 2.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -1.9740 3.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -3.6740 2.8530 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -4.7100 1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 -5.4660 2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 -5.0360 2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3640 -5.7290 2.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -6.8530 3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8740 -7.2830 3.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -6.5920 3.2310 C 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 0.0250 -0.1510 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -2.8900 -2.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -2.0860 -3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -3.6530 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -3.4200 3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -4.2440 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -5.3990 1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 -4.1580 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3680 -5.3930 2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0050 -7.3940 3.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7140 -8.1610 4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -6.9310 3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 11 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 10 1 0 0 0 0 8 9 2 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 M END