IBS-ZINC05278512 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -0.9400 -1.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2780 -1.5850 -1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 -1.9740 -0.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7040 -1.8240 -3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9820 -2.5390 -3.1240 N 0 3 0 0 0 0 0 0 0 0 0 0 8.1850 -1.9650 -3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1210 -2.9510 -3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4350 -4.1410 -3.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1220 -3.8390 -3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3060 -5.1090 -2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3330 -6.1710 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6510 -5.5920 -3.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5880 -2.7800 -3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1440 -1.5000 -3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5120 -1.3460 -3.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3340 -2.4580 -3.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7880 -3.7310 -3.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4200 -3.8970 -3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8260 -5.1200 -3.5350 Cl 0 0 0 0 0 0 0 0 0 0 0 0 15.0560 -2.2560 -3.5630 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -0.6280 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 -2.4210 -3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8160 -0.8680 -3.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 -0.9060 -3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -4.9800 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8630 -5.3890 -3.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 -6.2430 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1140 -7.1410 -2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8610 -6.0020 -3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4720 -5.8110 -2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5040 -0.6310 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9440 -0.3560 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9960 -4.8900 -3.3440 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 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 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 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 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 47 1 0 0 0 0 M CHG 1 12 1 M END