IFLAB-ZINC04338230 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 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 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.1030 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5360 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -1.9290 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -2.6740 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -2.0290 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -2.7540 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -4.1770 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 -2.6160 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9970 -3.9400 0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 -4.6000 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 -3.8660 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2650 -2.4610 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0760 -1.8840 0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5670 -1.9930 0.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4000 -3.0510 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6150 -2.9840 0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6870 -4.1930 0.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0520 -5.0920 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9530 -0.6450 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3000 -0.3080 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6780 1.0210 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7150 2.0160 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3720 1.6820 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9890 0.3540 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0870 3.3140 0.1200 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.1830 -6.0810 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2460 -6.6690 0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 -6.7760 0.0130 N 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 -2.3290 1.1820 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 0.0430 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -3.7540 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -4.6310 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -4.5010 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -4.4840 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0510 -1.0840 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7260 1.2830 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6220 2.4590 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9410 0.0940 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 -6.3060 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0460 -7.7460 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 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 11 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 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 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 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 43 1 0 0 0 0 27 44 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 45 1 0 0 0 0 31 46 1 0 0 0 0 M END