IFLAB-ZINC04163810 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.0600 1.5600 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 0.0310 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -0.5160 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -0.7920 -1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 -1.2930 -1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 -1.5210 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -1.2420 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -0.7460 0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1450 -2.0280 0.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 -2.4140 1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3950 -1.2340 2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9310 -2.1610 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4890 -1.9110 -2.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 -2.6160 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2150 -1.8120 -0.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -4.0290 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9410 -4.5900 -1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8460 -5.9180 -1.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6020 -6.5260 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5260 -6.2990 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7360 -5.1430 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3520 -5.2300 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7610 -6.4570 -1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5390 -7.6000 -1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9110 -7.5280 -1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2280 -3.8290 -0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 1.9560 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8880 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 1.9260 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -0.3340 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.2970 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 -0.6140 -2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9030 -1.5080 -2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -1.4180 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -0.5340 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3300 -3.2600 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 -2.6970 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7710 -1.5220 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -0.3880 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2310 -0.9520 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7440 -4.3410 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 -6.5290 -1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0660 -8.5560 -1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5080 -8.4240 -1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6480 -3.5740 -1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9360 -4.4480 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0290 -2.9160 -0.2890 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 2 30 1 0 0 0 0 2 31 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 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 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 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M END