CHEMBRIDGE-ZINC00088690 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 29 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2410 -0.6500 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.1200 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 1.4360 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 2.0730 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -2.1310 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 -2.7890 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -4.5180 -0.0420 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -4.1810 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -2.8980 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -5.1390 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -6.4860 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -7.3870 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -8.6800 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -9.0870 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -8.1180 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -6.8410 -0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 1.9130 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -0.5700 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3680 -0.3660 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 3.1530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -2.3360 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -4.8660 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7410 -9.4100 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -10.1370 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 -8.4010 -0.0640 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 M END