IFLAB-ZINC02457189 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -1.8160 0.4940 -0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -0.4670 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 -1.0050 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -1.8930 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.2540 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -1.7290 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -0.8480 -1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -0.2950 -2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 0.8070 -2.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -1.0530 -3.5810 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -0.5590 -4.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -0.5100 -5.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 -1.7840 -5.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 -2.3460 -4.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -2.3610 -3.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 -2.3580 -6.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 -1.5670 -7.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4170 -2.1260 -8.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 -3.5060 -8.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9750 -4.3440 -7.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 -3.7500 -6.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1340 -5.8490 -7.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 -6.5430 -6.8040 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3910 1.4760 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 0.1220 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 0.6260 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -0.7340 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -2.3000 2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -2.9400 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 -2.0050 -1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 0.4330 -5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -1.2460 -5.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 0.2910 -5.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -0.2600 -6.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9730 -1.7140 -3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -3.3560 -4.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -3.0890 -3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -2.6750 -2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -0.4830 -7.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 -1.4820 -9.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 -3.9360 -9.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -4.4200 -5.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8290 -6.3050 -8.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 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 15 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 2 0 0 0 0 M CHG 1 23 -1 M END