IFLAB-ZINC04359346 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 -1.8220 0.2420 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 0.8230 3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 2.5580 1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 3.4950 2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 4.8840 2.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 5.3770 1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 6.5780 0.9910 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0930 6.9100 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 8.1470 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3340 8.3050 -1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1870 7.2380 -1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9970 6.0210 -1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 5.8520 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4560 4.4480 0.7400 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2080 7.3800 -2.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5980 8.7180 -2.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 9.5340 -3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5140 9.5140 -2.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 5.6820 2.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 6.8510 2.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 5.1370 3.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 5.9890 4.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 5.4810 5.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 4.1130 5.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 3.2610 4.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 3.7680 3.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 3.5840 6.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 3.1650 7.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -0.7830 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 0.3500 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 0.4730 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 0.8140 3.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -0.1630 3.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 1.5630 4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 2.7690 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 2.7130 1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 3.2710 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 3.3550 3.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 8.9780 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6590 5.1960 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2330 8.7120 -3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1390 9.1570 -2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 9.0900 -4.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5980 10.5620 -3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 7.0460 4.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 6.1400 6.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 2.2030 4.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 3.1090 3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 1.1640 2.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 49 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 49 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 3 0 0 0 0 M END