IBS-ZINC04041043 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.0400 1.5150 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 0.0160 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.6980 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -2.0950 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -2.8080 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -2.0860 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -0.6880 -1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -4.3300 -0.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0190 -4.6550 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -4.8880 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -6.3940 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 -8.3400 -1.3220 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7940 -8.8320 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -8.7260 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 -8.7300 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 -9.4660 -3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 -9.8120 -4.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2540 -9.4240 -4.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7990 -8.6900 -3.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0080 -8.3430 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -4.8860 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -5.1030 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -5.6630 -0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -5.7510 -2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -5.2850 -1.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 1.8420 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 1.9320 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 1.9250 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -0.1680 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -2.6180 2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -2.6050 -2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -0.1520 -2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -4.6580 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -4.3890 -0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -6.6340 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -6.9580 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -8.5680 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 -9.7870 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -8.1460 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -9.7820 -3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 -10.3870 -5.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8710 -9.6950 -5.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8430 -8.3900 -3.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 -7.7680 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 -4.8800 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 -5.9620 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -6.1020 -3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -6.8580 -1.3540 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3590 -6.6000 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -6.3510 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 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 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 48 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 48 1 M END