IBS-ZINC00500529 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.8240 1.8430 -1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 0.4720 -0.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -0.2760 -1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 0.2900 -2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -0.4910 -3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -1.8570 -2.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -2.4100 -1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -1.6330 -1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -2.1890 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -3.5700 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -2.6810 -3.6120 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0970 -3.9510 -3.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -2.1450 -4.6110 O 0 5 0 0 0 0 0 0 0 0 0 0 2.5030 0.0880 -4.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 0.9830 -3.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 1.6580 -4.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 1.8770 -6.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 2.5700 -7.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 2.8420 -7.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 2.8590 -6.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5630 2.3220 -4.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5480 2.4800 -4.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7050 3.1740 -4.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8820 3.7070 -5.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9120 3.5480 -6.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 -0.2000 -5.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -0.4280 -6.6450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 2.3480 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 1.9030 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 2.3240 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 1.3320 -2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -3.4520 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -3.7120 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -3.8890 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -4.1640 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 1.1160 -2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 1.5310 -6.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4080 2.0640 -3.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4720 3.2990 -3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7880 4.2470 -5.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0610 3.9700 -7.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 3 0 0 0 0 M CHG 1 11 1 M CHG 1 13 -1 M END