NIH-ZINC04257959 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -0.4970 1.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -0.5200 -0.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -0.4240 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -0.5790 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 -0.9050 -2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 -1.0900 -3.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -0.9310 -3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -0.6050 -2.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -1.2180 -5.4630 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -1.5260 -6.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -1.4090 -5.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -1.8480 -7.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -2.0650 -7.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 -1.9770 -6.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 -2.4150 -9.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6580 -3.1710 -10.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1680 -3.4220 -10.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5040 -1.5860 -8.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 -1.3350 -8.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3310 -2.3420 -10.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0100 -0.9970 -10.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3960 -0.4220 -9.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0180 0.8120 -9.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2560 1.4710 -10.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8710 0.8960 -11.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2520 -0.3400 -11.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -0.4400 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 -1.0220 -2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -0.4890 -2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -1.9180 -8.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -3.3380 -9.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -1.6090 -9.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3890 -2.4740 -11.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1300 -4.1130 -10.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4330 -4.1400 -9.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4510 -3.8190 -11.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0320 -0.6440 -8.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7740 -2.2830 -8.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7120 -0.9390 -7.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 -0.6170 -9.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5700 -2.8660 -11.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6800 -2.9280 -9.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2100 -0.9370 -8.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3190 1.2620 -8.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7420 2.4360 -10.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0560 1.4110 -12.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9550 -0.7910 -12.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2860 -2.6000 -9.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8770 -2.1570 -10.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 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 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 53 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 54 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 54 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 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 M END