IBS-ZINC04733003 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7430 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6940 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 0.0100 -2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -0.6680 -3.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -2.0660 -3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.7700 -2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.0850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.7960 -4.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -4.0900 -4.9020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -4.8160 -6.1750 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0080 -4.1030 -6.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -5.6780 -6.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -6.6870 -5.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 -5.7120 -6.2490 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2290 -6.2520 -7.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 -4.8640 -6.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -4.5310 -7.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3080 -3.7520 -7.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7470 -3.3070 -5.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0470 -3.6410 -4.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -4.4230 -4.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -2.4730 -5.8800 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.5820 -2.1780 -6.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3520 -2.0800 -4.7940 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2040 -6.6470 -5.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -0.9410 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -1.6880 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -0.1510 2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 1.0900 -2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.1210 -4.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -3.8500 -2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -2.6280 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -2.2510 -5.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -6.1480 -7.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -5.0510 -6.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 -7.2720 -5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -4.8780 -8.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 -3.4910 -8.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 -3.2930 -3.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -4.6870 -4.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -6.2360 -4.2920 H 0 0 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 2 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 46 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END