IFLAB-ZINC04249148 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 0.1620 2.2040 0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 2.6000 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 1.7690 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 0.5440 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 0.1480 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 0.9790 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5110 -0.3610 -0.0840 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1750 -1.3080 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 -0.6060 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4470 -0.0870 1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 -0.5080 2.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8240 -1.2700 3.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 -1.3560 2.2790 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -1.8570 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2460 0.8030 0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3110 1.3700 -0.4770 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6810 2.1460 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 0.2880 -1.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 -0.1020 -2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7830 0.5460 -3.2940 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -1.0020 -2.7860 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 -2.3660 -2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 -3.3010 -3.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -4.6470 -2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 -5.0630 -2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 -4.1330 -1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 -2.7870 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -6.7540 -1.6990 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.1300 1.9590 -1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2810 1.6220 -1.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 2.8510 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 3.5570 1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 2.0780 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -0.8100 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 0.6700 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8190 -1.7520 4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6830 1.6210 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0370 0.2220 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 -0.7050 -3.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -2.9770 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 -5.3740 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 -4.4600 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 -2.0620 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 2.8580 -2.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1460 3.2070 -3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 29 30 2 0 0 0 0 29 44 1 0 0 0 0 44 45 1 0 0 0 0 M END