IFLAB-ZINC03911772 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 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 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 0.1160 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -0.4930 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -1.8950 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9190 -2.5540 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9280 -3.9180 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -4.6240 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 -5.9790 0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 -4.0040 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7620 -6.3680 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 -2.6670 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.0130 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2380 -4.6630 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5720 -5.1260 -1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8450 -5.8510 -1.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3420 -6.3540 -2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7350 -6.2070 -3.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6260 -7.0850 -2.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1440 -7.6080 -3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3420 -8.2890 -3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0330 -8.4560 -2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5240 -7.9380 -1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3240 -7.2610 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2070 -9.1240 -2.4800 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 -2.3210 1.1950 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 0.1000 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8420 -1.9940 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -2.5850 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1570 -5.5300 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0270 -4.0050 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6520 -4.2590 -2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 -5.7840 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3300 -5.9680 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6060 -7.4790 -4.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7430 -8.6940 -4.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0660 -8.0700 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9250 -6.8620 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 14 2 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 6 13 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 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 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END