NIH-ZINC02939687 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.8750 0.8660 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -0.3600 0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -0.6960 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 0.2510 -0.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 1.1940 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -1.8780 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -2.9310 0.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -1.8140 0.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -3.0630 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 -3.1150 1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 -0.6100 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 -0.5840 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0100 -1.9270 1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1660 -1.1970 1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0470 -0.8630 -0.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2640 -1.0190 1.8480 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -0.4220 1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7980 0.1010 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0540 0.6650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0260 0.7110 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7510 0.1940 2.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4800 -0.3680 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7750 0.2210 3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3130 -0.3220 4.5410 F 0 0 0 0 0 0 0 0 0 0 0 0 14.9030 -0.4780 3.0750 F 0 0 0 0 0 0 0 0 0 0 0 0 14.1760 1.4810 3.7020 F 0 0 0 0 0 0 0 0 0 0 0 0 14.5510 1.4190 0.6110 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 1.4320 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 -0.9410 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 2.0170 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -3.9360 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 -3.1160 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 -3.1120 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 -3.9970 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6190 0.2320 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 -0.5810 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 -0.4950 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 0.2980 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3000 -2.9760 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7730 -1.4890 2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1940 -1.3490 2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0810 0.0890 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2670 1.0670 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2640 -0.7730 3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7500 -1.8910 0.8440 N 0 3 0 0 0 0 0 0 0 0 0 0 6.1000 -1.8850 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 45 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 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 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END