IFLAB-ZINC04139261 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 0.3440 1.9510 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 0.4460 0.1130 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7110 0.2980 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -0.2250 0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9980 -1.2670 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -0.2500 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -1.3010 -2.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 -0.9890 -3.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 0.2870 -3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 1.1010 -2.0360 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 0.5450 2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 1.1310 3.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 0.3030 3.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 0.1810 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -0.4700 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -0.2230 -0.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -1.4950 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -2.1900 0.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -2.0040 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 -2.5150 -0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 -1.2380 -1.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 2.3590 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 2.1740 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 2.4940 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -2.2550 -2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -1.6680 -4.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2620 0.7810 -4.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 1.2300 2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -0.4470 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 1.1980 4.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9150 2.1430 3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 -0.4420 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6910 1.1690 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -1.4640 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8290 -0.5380 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 0.2560 -1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -2.5610 -2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -2.4520 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 -3.3880 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 -1.2500 -2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2130 -0.3160 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 0.3760 1.0740 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3730 1.3010 0.7090 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 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 42 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END