OTAVA-ZINC05012036 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.8580 1.0720 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 1.8260 3.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 3.4090 1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 3.5920 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 4.9920 0.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 5.8730 -0.6100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2640 5.8760 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 7.2340 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 7.0410 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1830 5.6120 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 5.1380 2.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 7.8490 1.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 8.3960 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 8.4260 -1.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 9.7040 -0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 10.6290 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 11.8860 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6230 12.2250 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 11.3130 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 10.0570 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 5.3420 -1.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 5.0790 -3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 4.6040 -4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 4.5890 -3.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 5.0390 -2.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3630 5.1310 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 0.0570 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 1.4640 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 1.0720 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 2.2050 2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 0.7710 3.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 2.4080 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.7790 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 3.9510 2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 3.1970 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 3.0390 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 9.3320 -2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 10.3790 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 12.6000 1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 13.2010 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 11.5800 -0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 9.3540 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 5.2260 -3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 4.3140 -5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 4.3050 -3.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 1.9520 1.9890 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5270 1.5890 2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 46 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END