IFLAB-ZINC04176822 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 2.9630 0.3660 -1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -0.7430 -0.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -1.1890 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -0.6490 1.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -2.2870 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -2.7240 2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -3.8680 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -4.5680 3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -5.6270 3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -6.0370 2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -5.3750 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -4.2820 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -3.2540 -0.3260 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -2.1300 3.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -2.8210 3.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 -3.9410 3.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7330 -2.2190 4.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8970 -1.4670 4.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5380 -0.9060 5.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 -1.0870 7.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 -1.8290 7.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 -2.3930 6.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 -3.1140 6.3390 F 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 -1.2890 3.4180 F 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 0.1010 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 0.6230 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 1.2220 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -4.2610 4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -6.1530 4.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -6.8790 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -5.6990 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -1.2180 3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4370 -0.3250 5.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 -0.6460 7.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 -1.9660 8.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 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 24 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 M END