IBS-ZINC02347011 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 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 2.4000 0.0100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 1.8420 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 0.6880 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -0.3900 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 -1.3130 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 3.2150 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6320 3.4520 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2490 4.7310 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6980 5.8190 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6970 4.4610 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8270 5.2790 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0730 4.7180 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2180 3.3330 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1050 2.5080 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8320 3.0630 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6020 2.5070 -0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2760 1.0110 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7450 -0.8950 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8800 -1.3470 2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1990 0.2660 3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0630 0.7170 1.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6680 -1.6400 4.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2640 -1.6480 5.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4480 -2.5910 4.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4610 2.7870 -0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9080 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 1.2000 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6230 0.6480 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 4.0420 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7170 6.3530 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9480 5.3510 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4280 0.5520 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1970 0.7530 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7010 -1.0150 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9890 -1.5010 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 -2.4020 2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6560 -0.7600 3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9550 0.8710 3.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2420 0.3860 3.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2880 0.1300 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 1.7730 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3140 -0.9880 5.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0720 -2.6530 4.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 -1.9290 6.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8250 -0.6540 5.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5420 -2.6500 5.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8290 2.6250 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3440 0.5180 1.3040 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6000 -1.1480 3.4900 N 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 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 34 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 15 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 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 55 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 56 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 M END