NIH-ZINC04099437 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7040 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0760 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7970 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0790 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -3.2280 -2.5420 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -4.5690 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.1310 -0.1950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -5.9080 -1.7630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -6.8590 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -6.5440 0.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -8.3150 -1.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7860 -8.5470 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -8.6060 -2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -10.0770 -2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 -10.9630 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -10.5890 -0.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -9.1810 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -11.7320 0.2110 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -11.0400 0.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -12.8010 -0.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -12.3680 1.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -12.1660 2.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -12.6550 4.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -13.3540 4.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -13.6030 3.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -13.0960 1.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 -13.4220 0.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -14.2330 1.3320 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 -14.2490 2.8400 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1640 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6070 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1400 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -6.1600 -2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -7.9740 -2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -8.3970 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -10.2930 -3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -10.2780 -3.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -12.0090 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -10.8140 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -8.8880 0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 -9.0510 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -11.6140 2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -12.4720 5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -13.7200 5.1400 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 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 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 32 2 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 M END