IFLAB-ZINC02456520 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 0 0 0 0 0 0999 V2000 -0.0030 1.6050 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 0.1000 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -0.4620 -0.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -0.5850 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -2.0550 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -2.6020 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 -2.0020 1.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -0.5320 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 0.0280 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 -2.8230 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2750 -4.0520 1.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7040 -2.1180 1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8880 -3.0800 1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2000 -2.3080 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4530 -3.1690 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3440 -4.3900 1.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 2.0130 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 1.9320 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 1.9900 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 -2.3810 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -2.4500 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -3.6930 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -2.3430 2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 -0.1150 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -0.2310 2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 1.1150 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 -0.2110 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7690 -1.5090 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7470 -1.4570 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7980 -3.7370 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8760 -3.7310 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3240 -1.7090 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1670 -1.6080 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4660 -2.5310 0.6480 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 M CHG 1 34 -1 M END