IFLAB-ZINC04519425 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -2.0260 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -2.6710 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.9280 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -0.5320 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.1060 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 -2.6160 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 -3.8310 0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0960 -1.8970 0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3920 -2.5800 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5150 -1.5420 0.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.4250 -0.9230 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8490 -2.2440 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7740 -2.1260 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9240 -2.8680 0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9320 -3.5890 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4260 -3.3390 -1.1630 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.3930 -0.4950 -1.3990 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2330 0.3230 -1.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6990 -1.2430 -2.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7330 0.6390 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5490 1.8420 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6000 2.7320 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8350 2.4190 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0190 1.2160 -1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9670 0.3290 -1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -2.5990 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -3.7500 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 0.0460 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 1.1850 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0580 -0.9280 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4830 -3.1990 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4650 -3.2090 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6360 -1.4980 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7510 -2.8640 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7410 -4.2270 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5840 2.0860 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4570 3.6710 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6570 3.1140 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9840 0.9720 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1090 -0.6090 -2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 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 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 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 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 M END