IFLAB-ZINC04940886 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -0.8490 -1.1460 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -1.2370 -2.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 0.2930 -0.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -2.2730 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 -2.7160 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 -3.8670 1.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 -4.4300 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 -3.9850 0.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 -5.5910 2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4390 -6.1780 2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 -7.2600 3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3520 -7.7650 3.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -7.1880 3.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 -6.1020 2.7840 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 0.5290 -0.3650 0.8850 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 -1.4180 -1.6240 0.0070 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 0.1970 -0.5710 -2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -1.9920 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -3.0940 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 -2.9970 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 -1.8960 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 -4.2220 1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3400 -5.7850 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4600 -7.7150 3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4100 -8.6130 4.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2280 -7.5870 4.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 -5.6500 2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 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 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 M END