CHEMBRIDGE-ZINC05027773 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -1.3390 1.4510 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -0.0540 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -0.6920 1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -2.0700 1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -2.8170 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 -2.1740 0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -0.7940 0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -0.0950 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -4.2130 1.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -4.8630 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -4.2370 0.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -6.2750 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -7.0670 2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -8.4270 1.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -9.0730 0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -10.7850 0.7420 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -8.4190 -0.4330 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -6.9470 -0.4180 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9450 -6.6010 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -6.4790 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -6.9610 -0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -6.5340 -1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -5.6210 -2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -5.1390 -2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -5.5650 -2.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -4.1650 -4.0660 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7790 -3.7420 -4.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -3.7870 -4.7080 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0940 -6.4390 3.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 1.7800 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3600 1.7920 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 1.8690 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.1100 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -2.5680 1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2310 -2.7510 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 0.0400 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 -0.6970 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 0.8790 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -4.7140 1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -8.9560 2.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -8.9070 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -7.6720 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 -6.9110 -1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -5.1860 -2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -6.2010 3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -7.1370 4.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -5.5260 3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 -5.2000 -3.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8420 -4.4130 -3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 40 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 41 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END