IFLAB-ZINC04939712 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 -1.2940 1.5560 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 0.2130 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -0.4130 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -1.6450 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -2.2560 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -1.6350 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.4000 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 0.2280 -2.4760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -0.5050 -3.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -1.7160 -3.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 0.1790 -4.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -0.8740 -6.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0850 -1.5340 -5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -0.1920 -7.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -0.2760 -8.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -2.7130 -7.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -3.5590 -7.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 -1.6430 -6.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 -0.7970 -6.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5870 -3.4820 -7.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -3.5750 0.3070 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2680 -4.1230 1.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -4.1130 -0.6550 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5650 2.3460 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 1.6540 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 1.6400 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 0.0610 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1320 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -2.1120 -1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 1.1920 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 0.7830 -5.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 0.8200 -4.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -3.3480 -6.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -2.2550 -8.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -4.3210 -7.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 -4.0390 -6.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5430 -2.1020 -5.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2980 -1.0090 -6.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -0.3170 -7.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 -0.0350 -5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7250 -4.0050 -6.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5230 -4.2080 -8.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -2.8170 -7.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 0.5100 -7.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -1.6620 -6.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 -2.6940 -7.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 0.9310 -8.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 45 1 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 16 45 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 46 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 45 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 44 47 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END