NIH-ZINC04092558 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0030 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.6860 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.0180 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.4220 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 2.0990 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 1.8350 -0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 0.7920 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -0.3560 -0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -1.7260 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 -2.1940 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 -1.4570 -2.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 -3.4330 -1.7200 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1090 -4.0160 -3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6270 -5.4550 -2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -5.7970 -1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2770 -4.4260 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 0.8600 -0.0520 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4770 2.6530 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9520 2.9580 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7590 2.0530 -0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3760 4.2380 -0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7440 4.5230 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6720 3.6850 -0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0220 3.9640 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4540 5.0810 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5260 5.9240 0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1730 5.6460 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1980 6.9400 1.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5160 6.9380 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7080 5.5700 0.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9070 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -1.7660 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 3.1780 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2110 -1.7500 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 -2.3810 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 -4.0360 -3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8510 -3.4300 -3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1870 -6.1320 -3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7150 -5.4840 -2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0960 -6.1290 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7770 -6.5460 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3080 -4.2650 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 -4.3720 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0150 3.0840 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 3.0810 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7340 4.9620 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3370 2.8130 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7410 3.3110 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4520 6.3010 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5550 7.6040 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2610 7.2250 1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 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 17 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 16 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 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 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 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END