NIH-ZINC03874778 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 0 0 1 0 0 0 0 0999 V2000 0.6900 -5.9190 -4.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -4.9810 -2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -5.5930 -1.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -4.6460 -0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -5.2620 0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -4.3400 1.9870 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4090 -4.0490 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -4.9750 3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -5.6120 4.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -5.9330 4.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -6.6320 5.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -6.7470 5.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -7.3190 6.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -6.0920 4.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -5.5080 3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -7.2720 6.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -6.4340 7.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -7.1030 9.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -6.2970 10.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -6.9590 11.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -6.1820 12.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -6.7910 14.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -7.6730 13.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -3.1220 1.7770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -6.8640 -3.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -5.4610 -5.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -6.1410 -4.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -4.0350 -3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -4.7530 -2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -6.5410 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -5.8220 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -3.6980 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -4.4190 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -6.2260 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -5.4620 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 -4.9010 3.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -5.9610 5.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -6.8390 3.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 -5.3120 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -4.4170 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -5.8870 2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -8.2700 6.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -7.4400 6.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -5.4370 7.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -6.2900 8.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -8.1150 9.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -7.2050 8.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -5.2820 10.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -6.2030 10.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -7.9880 11.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 -7.0220 11.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -5.1630 12.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -6.0980 13.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 -3.3480 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -6.3160 15.2290 O 0 5 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 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 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 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 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 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 2 0 0 0 0 22 55 1 0 0 0 0 24 54 1 0 0 0 0 M CHG 1 55 -1 M END