FDA-ZINC03830976 MOE2007 3D CORINA 3.40 0006 02.08.2006 87 93 0 0 1 0 0 0 0 0999 V2000 3.5200 -0.8430 2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -2.3580 2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 -2.6920 1.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4600 -2.2620 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 -4.2110 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 -2.1350 0.8440 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8390 -1.2300 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 -0.7250 -0.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1580 -0.9870 0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6280 -1.7530 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6460 -2.4390 1.5790 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9200 -0.1040 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2760 0.0530 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0260 0.9220 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4240 1.6380 -2.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0680 1.4810 -2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3200 0.6080 -1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1840 2.5190 -3.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3530 3.1690 -4.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2020 4.1800 -4.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3440 3.4880 -5.4610 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1740 2.8380 -4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3260 1.8270 -3.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1040 4.3690 -6.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2310 3.9100 -6.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9810 4.7800 -7.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6080 6.1120 -7.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4820 6.5720 -7.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7280 5.7020 -6.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3470 6.9680 -8.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9050 8.3260 -8.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8540 9.1310 -9.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 14.9560 8.6660 -10.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3800 10.6000 -9.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6030 11.3150 -9.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6860 10.4980 -9.4200 C 0 0 3 0 0 0 0 0 0 0 0 0 16.1460 9.2930 -8.8510 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6040 10.1460 -10.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2010 11.3710 -11.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 19.5130 11.6410 -11.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6340 12.8340 -11.7750 N 0 0 0 0 0 0 0 0 0 0 0 0 18.4280 13.3550 -11.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5180 12.4940 -11.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 17.4700 11.2460 -8.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2040 12.5810 -8.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9230 13.2670 -7.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9100 12.6180 -6.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1760 11.2820 -6.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4530 10.5940 -7.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7820 8.9160 -7.9460 Cl 0 0 0 0 0 0 0 0 0 0 0 0 19.8130 13.4800 -5.2440 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -0.3550 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -0.4900 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -0.6060 3.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 -2.7110 3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -2.8460 2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 -4.6410 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -4.6250 1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 -4.4480 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6480 -1.7750 1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7440 -0.5030 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0810 1.0440 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6000 2.0380 -3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 0.4820 -1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9670 2.4160 -4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5220 3.6840 -3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5950 4.6420 -5.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5650 4.9480 -4.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0060 2.3230 -4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5610 3.5920 -3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9330 1.3650 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9620 1.0590 -4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5220 2.8730 -6.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8580 4.4230 -8.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1920 7.6090 -7.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8480 6.0580 -5.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8980 8.3620 -9.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8980 8.7520 -7.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6800 10.7070 -10.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9310 10.9440 -8.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3930 9.4780 -10.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0240 9.6520 -11.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3240 10.9860 -10.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2330 14.3290 -12.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4350 13.0880 -8.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7150 14.3100 -6.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9460 10.7750 -6.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 52 1 0 0 0 0 1 53 1 0 0 0 0 1 54 1 0 0 0 0 2 3 1 0 0 0 0 2 55 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 57 1 0 0 0 0 5 58 1 0 0 0 0 5 59 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 60 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 61 1 0 0 0 0 14 15 1 0 0 0 0 14 62 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 63 1 0 0 0 0 17 64 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 65 1 0 0 0 0 19 66 1 0 0 0 0 20 21 1 0 0 0 0 20 67 1 0 0 0 0 20 68 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 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