NCID-ZINC01652994 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 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 0.0230 -0.7020 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0910 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7480 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.9650 -0.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0130 -1.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6700 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0400 -2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6890 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.5090 2.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -3.4270 2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -1.4010 3.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.3380 2.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -1.3880 4.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 -1.2440 5.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -1.2080 6.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -1.3290 7.6750 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -1.0760 6.9860 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 -1.0360 8.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 -0.8840 8.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3720 0.2850 8.8410 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9670 1.1660 8.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7120 -0.0080 8.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8240 -1.3880 8.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5950 -1.8690 8.6730 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 -1.9700 9.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1590 -1.2020 9.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2490 -1.7310 9.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0650 0.1340 9.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8740 0.7580 9.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8020 1.9700 9.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2750 0.9240 9.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2200 -3.4230 8.8830 C 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 -1.0120 -2.8710 -2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -2.0600 -3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.6390 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -0.5510 5.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 -2.3220 5.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -1.1760 4.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -1.0070 6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7280 -0.1910 8.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 -1.9620 8.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1380 0.2590 9.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4150 1.6330 8.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1730 1.4660 10.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3960 -3.6880 7.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0640 -3.7540 9.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3090 -3.9090 9.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 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 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 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 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 34 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 31 32 2 0 0 0 0 33 47 1 0 0 0 0 33 48 1 0 0 0 0 33 49 1 0 0 0 0 34 50 1 0 0 0 0 34 51 1 0 0 0 0 34 52 1 0 0 0 0 M END