CHEMDIV-ZINC00956537 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.9790 1.4300 -0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -0.0920 -0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -0.5520 0.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -1.8780 0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -2.6300 0.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -2.4200 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 -1.5780 3.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -2.0260 4.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 -1.1580 5.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 -1.6670 6.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 -3.0360 6.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4340 -3.9080 5.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -3.4200 4.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -4.2780 3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -3.7340 2.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -5.6420 3.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -6.4600 2.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 -7.7480 2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -8.5520 1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -8.0770 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -6.7950 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -5.9870 2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -9.1070 -0.1720 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -8.2360 -1.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -10.0680 -0.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 -9.9440 0.6520 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 -9.2670 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -9.9490 1.6160 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -9.3320 2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7500 -7.9570 2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6190 -7.2750 1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -7.9530 1.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 1.7170 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 1.7750 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 1.8840 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -0.3790 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -0.5460 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5070 -0.0940 5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 -0.9980 7.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 -3.4130 7.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 -4.9680 5.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -6.0350 4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 -8.1190 3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -9.5540 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -6.4270 0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -4.9880 2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -10.9090 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6630 -9.8940 2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5790 -7.4290 2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 -6.2040 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 15 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 30 31 2 0 0 0 0 30 49 1 0 0 0 0 31 32 1 0 0 0 0 31 50 1 0 0 0 0 M END