IFLAB-ZINC04941588 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -9.8580 -0.0630 4.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6210 -1.4410 3.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3930 -1.6860 3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2460 -3.1860 2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9310 -3.4480 2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7890 -4.8840 2.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 -5.3520 1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8370 -4.5840 0.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5560 -6.8160 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4200 -7.5850 1.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4670 -7.2840 0.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2930 -8.6550 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2910 -9.5990 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6930 -10.8370 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -10.6650 0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 -9.3030 0.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 -8.7120 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -9.3260 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -8.7410 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -7.5450 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -6.9310 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -7.5140 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6480 -12.0190 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2590 -11.2350 -0.4220 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.8120 -9.6060 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8090 0.0390 4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0540 0.3170 4.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8910 0.5070 3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3960 -1.1500 2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5590 -1.3400 3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2430 -3.7220 3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0800 -3.5320 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9330 -2.9120 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0970 -3.1020 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4800 -5.4980 2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 -6.6660 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -10.2600 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -9.2180 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -7.0900 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -5.9970 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -7.0360 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 -12.6900 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6970 -12.5530 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1570 -9.5280 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2220 -8.7970 -0.3190 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 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 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 36 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END