IFLAB-ZINC02722849 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3990 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 1.1780 -0.6670 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 0.0120 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.3810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 2.0560 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 1.4370 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7580 0.0340 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 -0.6790 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 -1.8970 -0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0650 -0.4570 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0320 0.4720 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3400 2.0850 -0.0450 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4670 0.1810 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8540 -0.9730 -0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3600 1.1900 -0.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7960 0.8990 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5820 2.2110 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8090 3.1370 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2970 2.7780 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6560 2.1320 -1.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9090 0.9410 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4180 1.2820 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9300 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -1.7470 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.1680 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2820 -1.5140 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0520 2.1100 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0570 0.3180 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0420 0.3280 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3210 2.7920 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3360 2.7820 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5180 3.5780 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6270 3.8520 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8880 3.6860 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4890 2.1060 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2200 0.5210 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0900 0.2160 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2290 1.9660 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8410 0.3680 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0220 1.9190 -0.1050 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 M END