CHEMBRIDGE-ZINC01140689 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.2070 1.2420 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.1250 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -0.6700 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.1620 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 1.5290 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 2.0810 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 3.5470 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 4.0590 0.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 4.3170 -0.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 3.7080 -1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 4.2820 -3.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 5.8100 -3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 6.3340 -2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 5.7820 -0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -2.0170 -0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 -2.6900 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -2.0000 -2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.6860 -3.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -4.0600 -3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -4.7520 -2.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -4.0700 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -4.9380 0.1070 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -4.7930 -4.6320 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7640 -4.1850 -5.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -6.0040 -4.6870 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1840 1.6640 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 -0.7740 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -0.2650 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 2.1750 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 3.9360 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 2.6270 -1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 3.9110 -4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 3.9760 -3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 6.1150 -3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 6.2210 -4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 7.4230 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 6.0080 -2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 6.0700 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 6.1840 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -0.9260 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -2.1480 -4.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -5.8260 -2.4080 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 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 14 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END