IFLAB-ZINC04519635 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 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 -1.2950 -0.6030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -2.1260 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -2.5650 1.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -3.8760 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 -4.6930 0.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -4.3240 2.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -3.5070 3.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -5.6350 2.9420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -6.0740 4.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -7.5970 4.1760 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9840 -7.9000 3.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -8.0490 5.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 -8.7160 5.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 -9.0240 6.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -8.6080 7.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -7.7700 7.0720 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -8.3560 4.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -8.0390 5.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -8.2020 2.7210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -10.0860 4.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -10.6850 5.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -12.0420 5.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -12.8010 4.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -12.2000 3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -10.8440 3.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -14.1270 4.5360 F 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 -1.8320 -0.2940 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.2840 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -2.5820 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -2.4290 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -1.9120 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -6.2880 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -5.6180 4.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -5.7710 5.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 -8.9940 4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 -9.5620 7.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -8.7600 8.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -10.0930 6.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -12.5100 6.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -12.7910 2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -10.3750 2.0850 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 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 M END