OTAVA-ZINC02550117 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 72 0 0 1 0 0 0 0 0999 V2000 0.0050 1.5050 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.0020 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -0.7520 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.1310 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -2.9800 1.9900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -2.5650 3.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -1.2490 3.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.3060 2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 0.8790 2.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -0.8500 4.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -0.6910 5.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -0.8910 4.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -0.3260 6.6880 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -0.1790 7.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 0.1860 8.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 0.2640 8.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6050 -0.0390 7.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4930 -0.4370 6.1300 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1170 -0.0430 7.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7230 -0.0660 8.7150 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5380 -1.0370 9.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0700 1.0330 9.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6200 0.6470 9.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2300 0.1800 8.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 0.4710 9.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -0.4240 10.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 1.7260 9.6210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 1.9340 10.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -2.4330 -0.7890 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.7130 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1330 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 1.0750 -2.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.9390 -3.5640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -0.3900 -4.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 0.8410 -5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 1.3810 -6.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 0.6970 -7.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -0.5310 -7.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -1.0820 -5.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -2.2910 -5.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -2.9420 -6.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 1.8840 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 1.8640 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 1.8560 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -3.2970 4.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 0.0980 5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -1.6150 5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -0.1650 7.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4380 -0.9280 6.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4440 0.8550 6.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6150 1.1460 10.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0910 1.9740 9.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 1.4930 10.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 -0.2010 10.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4140 1.1520 8.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6600 0.1630 9.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6910 -0.6000 8.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 1.6590 11.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 2.9840 10.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 1.3160 10.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -1.8990 -3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 1.3780 -4.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 2.3400 -6.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 1.1220 -8.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -1.0620 -7.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -3.1170 -7.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 -3.8960 -6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 -2.3110 -6.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 30 2 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 24 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 62 1 0 0 0 0 36 37 1 0 0 0 0 36 63 1 0 0 0 0 37 38 2 0 0 0 0 37 64 1 0 0 0 0 38 39 1 0 0 0 0 38 65 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 66 1 0 0 0 0 41 67 1 0 0 0 0 41 68 1 0 0 0 0 M END