IFLAB-ZINC00072085 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -0.6360 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.1000 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -0.5450 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -1.9290 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -2.6760 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0360 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -2.8300 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -2.2700 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -4.1770 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -4.9650 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -6.4330 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -7.1720 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -8.5320 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -9.1980 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -8.4340 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -7.0720 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -6.4630 -2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -7.2220 -3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -8.5810 -3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -9.2220 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -10.5590 -1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -11.5530 -2.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -10.4910 -0.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 0.0330 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -2.4240 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -3.7550 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 -4.6240 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -4.7190 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -4.7360 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -6.6770 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -9.0650 2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -5.4120 -2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -6.7460 -4.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -9.1340 -4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -11.2390 0.2450 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 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 25 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 41 1 0 0 0 0 M END