CHEMBRIDGE-ZINC02225659 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 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 -5.4860 -2.4780 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1360 -1.4340 2.8130 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5080 -1.6400 4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 -2.9020 4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4140 -3.4150 3.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7730 -4.7280 3.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3070 -4.6160 3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 -5.8970 3.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 -5.9030 3.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3170 -3.3780 5.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9310 -4.4820 6.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9990 -2.5970 6.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4310 -1.3770 6.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0430 -0.7000 7.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2030 -0.8850 5.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6900 0.4500 4.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2740 -3.0850 7.9600 C 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 -5.2860 -5.4370 3.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -5.0770 2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -3.9080 2.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -4.2680 4.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -6.9110 3.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -5.2220 3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -5.5810 4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6950 0.3710 4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7130 1.0780 5.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0250 0.8940 3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4580 -2.7960 8.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2060 -2.6510 8.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3610 -4.1710 7.9440 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 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 53 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 54 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 54 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 53 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 54 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 M END