IBS-ZINC01451553 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.0750 7.5690 2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 5.7780 2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 5.2550 1.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 5.6700 0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 4.5070 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 4.8190 -0.7480 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6210 5.1680 -0.6540 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6940 6.0070 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 5.6130 -2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8470 5.2250 -2.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 4.7850 -2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 4.5130 -2.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 5.2330 -4.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0810 6.2580 -2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0560 6.5610 -1.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3350 6.7110 -3.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3740 6.3600 -4.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2330 7.1130 -5.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9340 7.2210 -7.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4690 8.1220 -7.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3270 8.8960 -7.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6130 8.7970 -6.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1050 7.8970 -5.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5680 7.6630 -4.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4640 3.9870 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4920 4.1770 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2570 3.0810 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9880 1.8310 0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 1.7260 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1890 2.7690 -0.7360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 8.2700 2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 7.2980 3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 8.0140 2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 5.4550 3.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 6.5700 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 4.9390 2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 5.0770 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 4.3450 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 6.5200 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 6.0010 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 3.6260 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 4.2440 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7480 7.0890 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1450 5.6340 -4.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8180 6.6200 -7.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0030 8.2170 -8.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9840 9.5840 -8.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7250 9.3860 -6.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7100 5.1600 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0630 3.2040 1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5710 0.9610 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7020 0.7720 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 6.3240 2.0390 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9310 6.6010 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 53 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END