IFLAB-ZINC02719653 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -1.9610 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8580 -2.4370 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 -0.6580 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -0.1820 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -2.6150 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 -2.4760 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9300 -3.0060 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4890 -2.8730 3.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7840 -3.2890 4.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3370 -3.1690 5.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6570 -3.6080 5.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9370 -3.3770 6.8100 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.7730 -3.5730 7.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8260 -2.8230 7.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8880 -2.7020 6.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.3300 -4.1160 4.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.7700 -4.2100 3.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5360 -3.8050 3.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -2.4770 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -2.1800 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3690 -1.9410 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8820 -3.5160 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 -0.4400 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0220 -0.1410 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 0.8970 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -0.6780 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9120 -3.6650 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5140 -2.0410 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -3.0500 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -1.4260 2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5340 -2.4320 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9320 -4.0560 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9520 -2.4940 4.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7370 -2.5280 8.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3450 -4.6280 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.5120 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -2.1060 0.9700 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 43 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 44 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 18 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 41 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 M END