IBS-ZINC02365844 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3850 -2.1700 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 -4.0960 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -4.7770 -0.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -4.6820 1.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -4.1360 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -6.1420 1.3140 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1220 -6.5810 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -6.5700 2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -6.2050 1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -4.9700 1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 -4.6350 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -5.5350 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 -6.7700 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -7.1070 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 -6.6160 1.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 -5.8160 2.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 -2.2080 -1.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6330 -1.4380 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0960 -1.0540 -0.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 -1.0850 -2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 -0.2970 -2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9610 0.0080 -3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3830 -0.4630 -4.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2490 -1.2420 -4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 -1.5660 -3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5530 -2.3300 -3.5810 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 -2.6300 -2.4580 N 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -6.0610 3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 -7.6480 2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -4.2660 2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -3.6700 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 -5.2730 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -7.4730 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -8.0730 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8640 0.0720 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8510 0.6190 -3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8280 -0.2140 -5.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8080 -1.6030 -5.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 -7.9270 2.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5820 -8.1830 2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 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 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 53 1 0 0 0 0 22 23 1 0 0 0 0 22 32 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 53 54 1 0 0 0 0 M END