IFLAB-ZINC04121226 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 1 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1430 3.9620 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 5.4820 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 6.4040 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 5.5080 -2.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 4.2480 -2.1080 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0510 3.3640 -2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 4.4770 -1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 4.9340 -2.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 4.0860 -0.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 4.1420 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 4.6310 -0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 4.6850 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 4.2530 0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8650 3.7660 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 3.7040 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5100 4.3230 1.4620 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.7540 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 5.4760 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 5.8300 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 7.1960 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 6.8330 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 6.0080 -3.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 5.2510 -3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 4.9690 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4550 5.0650 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 3.4300 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 3.3200 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 4.1230 -0.7150 N 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 24 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 1 0 0 0 0 7 16 1 0 0 0 0 7 41 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 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