IBS-ZINC02296805 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 3.6420 0.0700 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 0.3570 -1.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -0.5570 -2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -0.2650 -2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -1.1190 -2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -2.2850 -3.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -2.5650 -3.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -1.7090 -2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -3.2040 -4.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -2.7750 -5.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -1.9950 -6.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -3.3320 -6.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -3.0620 -7.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -3.8710 -8.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 -4.4720 -7.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -3.8380 -9.9610 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -4.6010 -10.7750 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7460 -4.7250 -10.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -5.9580 -11.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -6.9150 -10.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -7.1880 -9.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -8.0610 -8.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -8.6690 -7.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -8.4040 -8.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -7.5330 -9.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -3.8790 -12.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -3.0550 -12.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 -0.8710 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 0.0560 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 0.8720 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 0.6350 -1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -0.8660 -2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -3.4530 -3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -1.9710 -2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -4.2340 -4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -3.2280 -3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -3.9660 -6.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -3.3610 -8.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -1.9930 -8.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -3.2520 -10.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -5.8020 -11.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -6.4620 -11.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -6.7140 -10.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -8.2630 -8.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -9.3440 -7.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 -8.8690 -7.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -7.3240 -9.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 -4.1970 -12.6790 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 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 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 26 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 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 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 48 -1 M END