IBS-ZINC02326674 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 0.1800 1.9610 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 2.5640 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 1.8070 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 0.4330 -0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -0.1540 -1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 0.6020 -1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 -0.3650 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 -1.1570 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 -1.9120 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8970 -1.8930 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2740 -1.1010 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 -0.3490 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1070 -2.6510 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0740 -2.0040 1.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0970 -4.0450 0.6430 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3570 -4.7730 0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2270 -5.9490 1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7830 -6.0730 1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 -4.8710 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0020 -8.1020 2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1710 -9.2130 1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 -10.4490 2.3150 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5850 -10.5770 3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 -9.6650 4.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7160 -11.9250 4.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 -12.1780 5.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3170 -13.4530 5.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0130 -14.4180 5.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5320 -14.0690 3.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4050 -12.8410 3.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 2.5490 -1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 3.6260 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 2.3090 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -1.2170 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 0.1270 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 -1.1700 -2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9310 -2.4980 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6580 -1.0640 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 0.2560 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6420 -5.1400 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1560 -4.1070 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1440 -6.5470 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9960 -5.6130 2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5650 -5.7490 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 -6.7430 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 -4.2830 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0320 -5.2190 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6000 -7.7890 3.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0280 -8.4570 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 -8.9090 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 -9.4390 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6580 -11.2870 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 -11.4130 5.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 -13.6950 6.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1460 -15.4200 5.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 -14.7940 3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0860 -6.8640 1.3370 N 0 3 0 0 0 0 0 0 0 0 0 0 7.3090 -7.1780 0.3830 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 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 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 39 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 19 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 42 1 0 0 0 0 17 43 1 0 0 0 0 17 57 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 18 57 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 25 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 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END