CHEMSTAR-ZINC04553655 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 0.0800 1.0330 -1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -0.3020 -1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -0.7920 -1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 0.0480 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 1.3840 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.8740 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 -0.5080 -0.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 0.1080 0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7300 1.1550 0.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0550 -0.6430 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8840 -0.9720 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9880 -1.6840 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0970 -1.9590 -0.7460 S 0 0 0 0 0 0 0 0 0 0 0 0 6.6410 -1.0910 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1670 -0.8510 -2.3070 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7310 -1.2930 -3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7170 -2.0080 -3.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9960 -0.7710 -4.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4380 -0.5990 -7.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0180 -1.3660 -8.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3300 -2.6050 -8.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4530 -3.4610 -7.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8310 -2.8100 -6.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8730 -2.0610 2.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9470 -1.7520 3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8570 -0.7530 2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 1.4180 -2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -0.9610 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 -1.8380 -1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 2.0760 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 2.9160 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 -1.4710 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3260 -0.2800 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 -0.9280 -4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2170 0.2970 -4.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0110 0.3110 -7.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3810 -0.3570 -7.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9040 -0.7720 -9.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0880 -1.5630 -8.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -4.3950 -7.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5100 -3.7020 -7.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 -2.6040 -6.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 -3.4290 -5.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1700 -3.1130 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7640 -1.4260 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4570 -2.6810 3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5030 -1.3620 4.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1420 0.2770 2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 -0.9740 3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 -1.4680 -5.9770 N 0 3 0 0 0 0 0 0 0 0 0 0 7.4980 -1.6760 -5.7680 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 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END