IBS-ZINC01471268 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 -0.1030 1.5040 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 0.0160 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -0.6220 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -2.0140 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -2.6990 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -1.9960 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -2.5890 0.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -0.6660 0.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 0.0580 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 0.4240 1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 1.6660 2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 1.9600 3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9510 1.0120 4.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 -0.1590 3.9370 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -0.4710 2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -4.1850 0.4510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4460 -4.4250 1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -4.6480 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -3.8680 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -2.6540 -0.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 -4.3340 0.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -5.9080 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -6.0610 2.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -6.9520 0.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -8.2050 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -4.8900 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -4.7320 -1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -5.3760 -3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -6.1830 -2.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 -6.3420 -1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -5.6980 -0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 -7.1320 -1.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 -7.2490 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -6.8170 -3.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -6.6070 -5.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 1.8750 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 1.7160 -1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 1.9960 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 -0.0670 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 0.9650 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -0.5750 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 2.3880 1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 2.9170 3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 1.2320 5.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4880 -1.4380 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 -5.2380 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 -3.7590 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 -8.1020 1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -8.5150 1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -8.9560 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -4.1030 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -5.2510 -4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0210 -5.8230 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 -7.6660 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0620 -6.2640 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 -7.9060 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -5.5460 -5.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -6.9480 -5.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -7.1690 -6.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 34 35 1 0 0 0 0 35 57 1 0 0 0 0 35 58 1 0 0 0 0 35 59 1 0 0 0 0 M END