CHEMDIV-ZINC06800376 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 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 0.7420 -0.5110 1.2420 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 -2.1020 -0.0730 1.1890 O 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 1.9720 -0.1320 -1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 0.5700 -0.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -0.6090 -2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -1.3880 -3.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -1.8830 -4.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9210 -1.8880 -4.9510 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 -1.3220 -3.7510 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9320 -0.5540 -4.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 -2.4220 -2.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -0.2490 -2.8780 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 1.0140 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 -2.3960 -5.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -2.8900 -7.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -3.2630 -7.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -2.9820 -6.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -2.4650 -5.7880 O 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 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 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 -3.0190 -0.3710 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -1.0370 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -1.6600 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 0.8600 -1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3210 1.3610 -3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 1.7600 -2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 -2.9780 -7.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -3.6920 -8.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -3.1500 -7.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 M END