IBS-ZINC05209675 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 0.0910 1.6220 -0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 0.1190 -0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -0.3550 -0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -1.8580 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 -2.3320 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -3.8340 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 -4.2880 0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 -4.7130 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2450 -4.7230 -2.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3040 -5.1640 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9210 -5.6140 -2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1450 -6.1750 -2.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8490 -6.5420 -3.4450 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.6210 -5.8150 -4.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3570 -6.5550 -3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8230 -5.1590 -2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8030 -4.4850 -3.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9000 -3.2640 -2.8820 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.5180 -2.5530 -3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9760 -3.2340 -1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3380 -4.3730 -1.8880 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4030 -7.9110 -3.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5820 -8.5180 -3.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0210 -5.1170 0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1810 -5.4740 0.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3550 -4.6680 1.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0750 -4.2770 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 -3.8860 2.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 1.9590 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 1.8210 -1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 2.1550 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -0.4140 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -0.0810 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 0.1780 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 -0.1560 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -2.3910 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -2.0570 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 -1.7980 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 -2.1320 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -4.3670 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -4.0340 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4220 -5.5150 -3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5600 -6.3360 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8750 -6.9130 -4.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5750 -7.2160 -2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3980 -4.8400 -4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7960 -2.4060 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8120 -4.6300 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9190 -8.4560 -5.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6020 -9.3360 -5.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 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 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 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 46 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 49 50 1 0 0 0 0 M END