IBS-ZINC04029213 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1970 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 1.4210 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 1.8400 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5270 0.7250 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -0.3750 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 -1.2940 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0380 0.7580 -0.0480 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4020 0.5400 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8120 3.1480 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 3.2380 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 -0.2630 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9080 0.1120 2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4000 -0.8250 3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5620 -2.1400 2.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2310 -2.5200 1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7310 -1.5830 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -1.9560 -0.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 3.1740 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8810 2.8990 -1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 4.1070 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 3.8540 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 3.6700 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7820 1.1380 2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6600 -0.5290 4.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9470 -2.8700 3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3580 -3.5470 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1270 -1.8850 -1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 2.1040 0.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3280 2.2510 1.3440 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 35 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 13 35 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 21 34 1 0 0 0 0 35 36 1 0 0 0 0 M END