OTAVA-ZINC02888283 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 1.1690 1.4150 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -0.0730 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 -0.9450 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -2.3090 -0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -2.8040 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -1.9260 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -0.5630 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -4.1870 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -4.8450 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -4.3060 2.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -6.3290 0.9760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7650 -6.6130 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -6.5570 -0.7990 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -4.8430 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -4.2710 -2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -2.8490 -2.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -1.7210 -2.7430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -5.1230 -3.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -6.3320 -3.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -4.5700 -4.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -5.4230 -6.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -4.5650 -7.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -4.1880 -8.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -3.3960 -9.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -3.3370 -8.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -4.0510 -7.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -7.1310 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -8.6010 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -9.3450 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -10.6940 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -11.2990 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -10.5540 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -9.2070 2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -12.9930 1.3580 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 1.7880 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 1.9080 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 1.6240 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -0.5590 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -2.9900 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -2.3080 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 0.1210 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -3.6070 -4.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -6.1090 -6.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -5.9930 -5.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -4.4410 -7.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -2.9290 -9.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -2.8080 -9.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -6.9370 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -6.8330 2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -8.8730 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -11.2750 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -11.0260 3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -8.6260 3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 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 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 14 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 13 1 0 0 0 0 11 27 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 3 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 M END