CHEMDIV-ZINC02621729 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.0400 1.3330 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 0.3630 -0.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -0.2920 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -1.2270 0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 -1.9670 0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 -1.7720 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 -0.8450 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 -0.1050 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 -2.5580 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -3.9330 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4490 -4.2750 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1860 -3.1140 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2890 -2.0430 0.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6110 -0.6640 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6450 -0.0660 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9350 1.2870 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1860 2.0580 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1400 1.4750 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 0.1110 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 2.2480 2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 1.7720 2.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 3.5410 2.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9520 4.3620 3.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6800 -3.0490 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0820 -2.8480 1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6060 -2.7900 1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1910 -3.9090 1.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 1.7640 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 0.8730 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 2.1460 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -1.3790 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.6860 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 -0.6910 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 0.6050 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 -4.6130 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8660 -5.2720 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2080 -0.6140 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7420 1.7460 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4330 3.1100 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0700 -0.3420 1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 3.9850 4.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 4.4110 2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 5.3710 3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1340 -2.2960 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1030 -4.0000 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7320 -3.6760 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6630 -1.9250 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0930 -1.6260 1.7920 O 0 5 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 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 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 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 48 -1 M END