IBS-ZINC05303471 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3730 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0160 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.7040 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0020 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4140 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 2.0910 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 2.1260 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 3.3430 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 1.3770 -0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 0.0210 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -0.6360 -0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 2.0360 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5680 2.2580 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8740 3.0550 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3420 3.2780 2.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5730 1.9240 3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2680 1.1270 3.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 0.9050 2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6270 1.1580 2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1410 1.6460 1.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9960 -0.0700 3.1580 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8920 -0.8220 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1880 -2.1270 2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0780 -2.8620 2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6440 -2.2650 0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3040 -0.9640 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4480 -0.2890 1.3230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.8940 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7840 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 3.1710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 -0.5410 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 1.4060 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0200 2.9960 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8060 2.8120 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6360 2.5010 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7090 4.0190 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2720 3.8460 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5800 3.8320 3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9070 2.0830 4.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4330 0.1630 3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 1.6810 4.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8690 0.3370 2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5610 0.3500 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6400 -0.4300 3.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7290 -2.5600 3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3270 -3.8780 2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3420 -2.8110 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7420 -0.4950 -0.2890 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 M END