IFLAB-ZINC04086935 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -0.5400 1.5410 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 0.0260 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -0.4760 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 -0.6700 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -0.2390 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 0.6890 -1.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.5850 -1.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -2.1590 -2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -3.5230 -2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 -3.7730 -3.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -2.5940 -4.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 -1.2250 -3.7910 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -2.4860 -5.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 -4.9840 -6.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 -5.0960 -4.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 -3.8180 -7.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8850 -2.8720 -7.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1230 -3.1560 -7.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1950 -2.2720 -7.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0420 -1.0970 -8.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8190 -0.8060 -8.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7450 -1.6880 -8.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -4.4940 -1.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -4.1560 -0.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -5.7760 -2.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 -6.7410 -1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 2.0840 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 1.9490 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 1.7640 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.2050 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -1.5660 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 -0.0440 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 -0.3770 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 -1.7610 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 -0.4100 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -2.2660 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -2.2360 -6.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 -1.7390 -5.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 -5.8950 -6.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 -4.8150 -6.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -5.4830 -3.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -5.8220 -4.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -3.6010 -8.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -4.8390 -7.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2700 -4.0700 -6.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1520 -2.5000 -6.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8780 -0.4100 -8.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7030 0.1110 -9.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 -1.4380 -8.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -6.5270 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -6.7590 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -7.7250 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -3.8120 -6.2230 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8960 -3.9220 -5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 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 36 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 53 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 16 44 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END