NIH-ZINC00359193 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 -0.1590 1.7980 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 0.4570 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -0.3780 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 0.1190 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 1.4920 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 2.3160 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 2.0590 0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 1.3120 0.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 3.4030 0.0910 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0160 4.0820 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 5.5550 0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 6.3100 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8240 6.1700 -0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9910 4.7060 -1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6690 3.9470 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 -0.7070 -0.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 -2.0460 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -2.7700 -0.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 -2.5350 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 -4.0170 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 -4.5240 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0470 -3.6540 -1.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 2.4380 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 0.0520 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -1.4220 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 3.3580 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 3.9480 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6630 3.5950 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 6.0380 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 5.6290 1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0080 7.3700 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8580 5.9250 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2070 6.6830 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 6.6650 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3940 4.6440 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7230 4.2290 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8430 2.8890 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 4.3260 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 -0.2300 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0780 -1.9390 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1390 -2.3270 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2090 -4.6050 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 -4.2240 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2300 -5.7720 -1.2630 O 0 5 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 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 21 22 2 0 0 0 0 21 44 1 0 0 0 0 M CHG 1 44 -1 M END