IBS-ZINC04428014 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 7.0050 1.8980 -0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3930 2.0400 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3770 1.1610 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 0.1260 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5520 -0.0020 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5890 0.8870 -1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 -1.0040 -2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 -1.2000 -2.4600 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9720 -0.7560 0.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -2.1560 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -2.6640 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -3.9960 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -4.8290 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 -4.3850 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 -3.0280 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1560 -2.5740 0.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2280 -3.3880 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1580 -4.7050 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9070 -5.2070 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 -6.2140 -0.7300 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7340 -6.4340 -1.8550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -7.0700 0.1300 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3590 -1.7860 0.0650 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4130 -2.0510 -0.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -0.8700 0.9040 O 0 5 0 0 0 0 0 0 0 0 0 0 7.8020 2.5730 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7120 2.8240 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9310 1.2640 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0660 0.7860 -2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 -0.3160 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -4.3760 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1730 -2.9280 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0440 -5.3260 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8500 -6.2520 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 -1.5590 -2.9860 O 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 29 1 0 0 0 0 7 8 1 0 0 0 0 7 35 2 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 8 -1 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 23 1 M CHG 1 25 -1 M END