NIH-ZINC01064259 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 0 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 0.0220 -0.6510 1.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -1.9760 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.6830 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -1.9670 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6380 -1.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.6310 -2.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.1900 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -4.8170 0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -6.5510 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -7.1320 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -8.4100 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -8.7370 0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 -7.5390 0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -7.3960 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -8.3050 -0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8240 -8.1620 -0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4010 -7.1140 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6040 -6.2080 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -6.3490 0.7500 C 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 0.0570 -2.4960 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -3.6000 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.1260 -3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.5460 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -4.5460 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 -9.1230 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4490 -8.8690 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4750 -7.0040 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0570 -5.3900 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 -5.6440 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 M END