IFLAB-ZINC04271408 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3850 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 1.2150 -0.6670 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 0.0010 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.3290 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 2.0620 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 2.0360 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 3.3450 -0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1090 3.6190 -0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 2.4930 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 1.4590 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3600 0.1370 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6460 -0.1290 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5960 0.9110 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1880 2.2080 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1900 -1.8050 -0.0480 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 -2.7380 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 -4.2150 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 -4.9040 1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3570 -6.2610 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4750 -6.8790 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3280 -6.1920 -1.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 -4.9000 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 1.9240 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.5610 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -1.7470 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 3.1420 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6510 0.6780 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9120 3.0090 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 -2.4850 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0520 -2.4830 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9850 -4.3950 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4790 -6.8290 2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6900 -7.9360 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 -4.3720 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 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 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 23 35 1 0 0 0 0 M END