IBS-ZINC06703155 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.4000 1.5110 1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 0.2430 2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -0.4740 2.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 0.0620 1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 1.3280 0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 2.0590 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 3.6520 0.2430 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 3.6660 -0.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 3.9350 0.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 4.7410 1.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 4.6920 1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 4.3990 3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 5.1990 3.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 5.0020 2.6540 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2780 4.1430 2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 6.2360 2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 7.1780 3.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 6.1820 1.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 7.2720 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 7.3080 2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 8.5090 1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7910 9.3620 2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0250 9.2890 2.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7170 9.7230 4.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7130 8.9010 4.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 8.9590 4.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -2.0390 2.8270 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 2.0520 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -0.1840 2.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -0.5020 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 1.7280 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 3.9450 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 5.6740 1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 3.3300 3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 4.6920 3.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 4.8540 4.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 6.2520 3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 5.3450 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 8.2110 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 7.1420 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 6.3770 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2120 7.3480 3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 9.4630 1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7850 8.4540 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0100 8.9700 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4020 10.3840 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8070 9.9470 2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4330 8.2720 3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5430 9.2750 5.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0860 7.8730 4.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 9.9810 4.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 8.2900 4.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6780 8.5060 2.6660 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.0260 7.5370 2.6990 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 27 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END