IBS-ZINC02136712 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 0.0180 1.2940 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -0.2360 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -0.7420 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -0.7200 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -0.7270 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -0.3320 -2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -0.2580 -3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1820 -0.5160 -4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3220 -0.9070 -3.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 -1.1780 -2.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -1.1420 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 -1.5190 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6270 -1.0330 -4.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7090 -0.2070 -4.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7090 -2.3420 -4.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4010 -2.6360 -5.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 -1.3870 -6.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 -0.3750 -5.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 0.7800 -6.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9730 0.9120 -7.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 -0.1000 -8.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0410 -1.2470 -7.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 0.0340 -9.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 -1.0430 -10.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 2.0310 -8.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 2.0470 -8.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 1.7650 -5.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 2.7480 -4.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7400 -0.9610 -3.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1310 -1.7760 -2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2220 0.2370 -2.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7350 1.2570 -3.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3680 0.3110 -1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 1.6540 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.6540 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 1.6630 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -0.6060 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -0.3730 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -1.8320 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -0.3820 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -1.0360 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 -0.0390 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 0.0690 -4.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 -1.4900 -1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9170 -3.1490 -4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5190 -2.2840 -5.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -2.9750 -4.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 -3.4160 -6.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -2.0300 -8.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 -0.8080 -11.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7630 -1.9570 -10.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3490 -1.1840 -9.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 1.2810 -9.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 3.0250 -8.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.8480 -7.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 2.2750 -4.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 3.5220 -4.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 3.1950 -5.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9760 0.3470 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9550 1.2080 -2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 -0.5690 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 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 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 M END