CHEMBRIDGE-ZINC04132194 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 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 1.2060 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0250 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.4130 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 2.0900 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.4870 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 4.2010 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 5.7090 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6190 -0.6610 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 -0.3270 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7210 -1.1440 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4180 -0.8840 -0.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6620 -1.1980 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 -0.3820 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -2.1610 -0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1730 -2.7810 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -2.7590 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 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 3.3160 1.9640 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 3.9840 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 3.9340 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 3.9250 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 5.9760 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 5.9850 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 7.4240 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.7360 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 -0.5650 2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3480 -0.8580 1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 -2.2050 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2460 -0.9520 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4220 -2.2610 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 -0.6600 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 0.6800 -1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 6.4250 0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 6.1460 -0.7320 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 16 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 27 36 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END