NIH-ZINC01162155 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0260 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4080 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.4370 0.0090 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -2.4410 -0.0210 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -2.8290 0.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -2.8610 0.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -2.9240 -1.6050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -3.1210 -2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -4.5750 -2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 -5.3680 -1.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -4.9940 -2.8430 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 -6.4070 -2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6980 -6.6100 -3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9100 -6.4980 -2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0830 -6.6910 -3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0570 -6.9780 -4.8410 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9220 -7.0930 -5.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7100 -6.9190 -4.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -3.1540 -2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -4.6060 -2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -4.8460 -3.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 -3.9080 -4.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -2.4560 -4.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -2.2160 -3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.5020 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 1.9600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -2.8240 -3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 -2.5140 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5810 -4.3600 -3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 -6.7040 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -7.0140 -3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9380 -6.2620 -1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0320 -6.6060 -3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9400 -7.3290 -6.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 -7.0180 -5.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -2.9580 -1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -4.8020 -3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -5.2740 -1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -5.8800 -3.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -4.6500 -2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -4.1040 -5.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -4.0790 -5.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 -1.7880 -5.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -2.2600 -3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -1.1820 -3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -2.4120 -4.1840 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END