IBS-ZINC02296404 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -4.7830 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -5.0650 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -5.5200 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2470 -5.5060 0.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -5.0760 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 -4.9410 2.3920 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -5.2920 3.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -4.5140 4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 -4.8810 5.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 -6.3820 6.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -7.1600 4.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4550 -6.7940 3.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3120 -5.8780 -1.5250 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0880 -5.7830 -2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 -6.1010 -3.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -5.3440 -3.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -4.9810 -2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -4.5840 -2.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 -5.2590 -4.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6050 -6.3610 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.6260 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.6360 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -4.6140 2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 -5.0380 3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -4.7680 5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 -3.4450 4.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -4.3270 6.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1220 -4.6270 5.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 -6.6360 6.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6770 -6.6440 6.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 -8.2300 5.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 -6.9060 4.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 -7.3480 2.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -7.0480 4.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 -5.5900 -5.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -4.2270 -5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -5.8970 -5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2820 -5.5170 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0300 -7.0590 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 -6.8670 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 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 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 2 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 M END