IBS-ZINC02212513 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 0 0 0 0 0 0999 V2000 0.8920 1.4530 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -0.0430 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -0.7630 -0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -2.1330 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -2.7920 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -2.0590 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -0.6910 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -4.2590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -5.0060 1.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -6.2980 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -6.3320 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -5.0190 -1.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -4.5490 -2.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -4.8690 -3.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -4.4040 -4.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -3.6200 -5.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -3.2990 -4.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -3.7680 -3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.5300 -4.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -2.0860 -6.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -4.7180 -5.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1070 -4.2050 -6.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -7.4760 -1.4090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -8.6080 -0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -9.8400 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -10.9850 -0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -10.9590 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -9.7880 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -8.5810 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 -7.4260 1.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 1.9340 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 1.7810 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 1.7270 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 -0.2510 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -2.6930 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 -2.5640 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -0.1230 2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 -5.4800 -2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -3.2570 -6.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -3.5230 -2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -1.4870 -6.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 -2.9500 -6.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 -1.4840 -6.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 -4.5800 -7.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 -3.1160 -6.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 -4.5280 -6.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -9.8760 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -11.9270 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -11.8820 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -9.7850 2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 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 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 2 0 0 0 0 11 12 1 0 0 0 0 11 23 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 M END