IBS-ZINC01810508 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.0270 1.2450 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -0.1500 -0.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -0.7350 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 0.0200 1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -0.5690 2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 -1.9290 2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -2.6900 1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -2.0940 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -2.8330 -0.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -4.2200 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 -2.5620 4.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 -3.7460 3.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -1.8270 5.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -2.4550 6.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 -1.4230 7.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 -0.2770 7.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2340 -1.7750 8.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5210 -0.8160 9.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0790 -1.1800 10.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3570 -2.5590 10.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 -3.8140 10.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5160 -4.9460 11.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1120 -4.8300 12.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3330 -3.5880 12.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9590 -2.4370 12.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0660 -1.0900 12.5080 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5740 -0.3050 11.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5390 0.9110 11.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6470 -0.5910 13.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1260 -0.3700 13.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6440 -0.6070 12.4980 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8740 0.0900 14.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 1.8000 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 1.5860 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 1.4140 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 1.0720 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 0.0220 3.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -3.7420 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -4.7020 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -4.6910 -1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -4.3250 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 -0.8820 5.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 -3.2530 6.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 -2.8690 5.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5280 -2.6920 8.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 -3.9030 9.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3480 -5.9230 10.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4050 -5.7200 12.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7980 -3.5110 13.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1710 0.3510 14.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4860 -1.3210 14.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4600 0.2800 15.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8260 0.2320 14.4710 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 27 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 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 2 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 M END