OTAVA-ZINC05606069 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -3.9380 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -4.7050 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -6.3870 0.5510 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -5.8960 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -4.6030 -0.9150 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -6.7560 -1.6850 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -8.0880 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -8.5360 -0.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -9.0210 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 -10.4060 -2.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -11.1070 -2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -12.3910 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -12.9560 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -12.2420 -0.7400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -10.9830 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -10.3460 -0.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -14.3770 -0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -10.4680 -3.4310 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 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 -3.4310 -2.1110 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -2.1010 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 -4.3560 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -6.3980 -2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -8.8890 -3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -8.7980 -2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -12.9670 -2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -15.0520 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -14.4830 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -14.6250 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -10.6460 -4.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0450 -10.9020 -3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 -9.3960 -3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 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 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END