IBS-ZINC06645702 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -1.9620 0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 -2.5960 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 -1.8590 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 -2.5050 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0680 -3.8860 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9010 -4.6280 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 -3.9870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -4.7150 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -6.1370 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -6.7800 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4030 -4.5850 0.0390 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2480 -5.6640 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1770 -4.1900 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1900 -4.1820 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5690 -2.9380 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2670 -2.9600 -2.6880 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6430 -2.1810 -3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3560 -4.2520 -3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6800 -5.0740 -2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6010 -6.4500 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1790 -6.9920 -3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8440 -6.1850 -4.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9400 -4.8250 -4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 -0.7800 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 -1.9290 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9470 -5.7070 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -6.4600 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 -6.4420 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -6.4750 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -7.8650 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -6.4580 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 -4.4000 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4090 -3.1250 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9550 -4.7170 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3560 -2.0510 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0850 -7.0840 -1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1180 -8.0560 -3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2960 -6.6280 -5.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4580 -4.2060 -4.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4250 -4.9610 1.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9760 -4.8330 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 50 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 44 50 1 0 0 0 0 50 51 1 0 0 0 0 M END