CHEMBRIDGE-ZINC01140838 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.1350 1.1640 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.1940 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -0.7020 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 0.1580 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 1.5180 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 2.0330 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 3.4900 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 3.9300 1.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 4.3340 -0.4750 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 5.7560 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 6.3050 -0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 6.3090 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 4.9260 -3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 4.5460 -2.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 3.7660 -1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -2.0420 -0.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -2.6350 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -1.8720 -2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.4780 -3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -3.8420 -3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -4.6050 -2.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -4.0040 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 -4.9610 -0.2080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -4.4870 -4.8840 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7460 -3.8160 -5.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -5.6890 -5.0320 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1110 1.5590 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -0.8660 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -0.2400 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 2.1870 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 5.9440 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 6.2570 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 5.6770 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 7.3220 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 6.7660 -2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 6.9220 -2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 4.1970 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 4.9420 -4.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 3.9240 -3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 5.4500 -2.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 3.7940 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 2.7290 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -0.8070 -2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -1.8840 -4.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 -5.6710 -2.7630 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 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 15 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END