NIH-ZINC04167841 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 0.0100 1.6260 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 0.1190 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -0.6540 1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -2.1450 1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -2.7240 0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -1.8450 -0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -2.3020 -1.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -0.3400 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -4.1940 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -4.8910 -0.6940 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -6.2710 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -6.8720 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -8.2740 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 -9.0160 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -8.3270 -0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -6.9820 -0.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -6.0910 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -5.1580 1.1990 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4440 -2.8250 2.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -0.1180 -0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 1.9820 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 2.2060 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 1.8550 1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -0.4550 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -0.2880 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 -0.0380 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 0.1210 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -4.7050 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -8.7780 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -10.0990 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -8.8560 -1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -3.7540 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 0.2230 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 -1.1740 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 0.4350 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 -6.4730 -0.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 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 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 17 18 1 0 0 0 0 17 36 2 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 M CHG 1 18 -1 M END