IBS-ZINC02310926 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -2.5480 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -4.0120 2.4650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -4.6840 3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -4.0730 4.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -6.1450 3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -7.0420 4.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -8.3990 3.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -9.4310 4.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -9.2340 4.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -10.3320 5.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -10.1220 5.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -8.8310 6.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 -7.7440 5.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -7.9210 5.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -6.8590 4.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 -8.2740 3.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -6.9600 2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -6.5070 2.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -9.3490 2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -9.5600 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -10.6200 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -11.4730 1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 -11.2660 3.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 -10.2040 3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 -12.6290 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -2.1700 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -2.1960 3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -4.4990 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -11.3390 5.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 -10.9690 6.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -8.6910 6.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -6.7500 6.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 -5.5540 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8550 -7.1400 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 -8.8940 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 -10.7840 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4120 -11.9340 3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 -10.0400 4.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 -12.3100 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8840 -13.4470 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5600 -12.9670 0.2650 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 21 2 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M END