IFLAB-ZINC04032811 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 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 0.7420 -0.5110 1.2420 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 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -0.1350 -1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -0.5770 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -1.3840 -3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -1.7390 -3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -1.2940 -2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -1.8610 -4.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -1.5500 -4.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -2.6400 -5.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -3.1120 -6.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -3.9710 -7.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -4.4570 -8.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 -5.6800 -8.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -6.1230 -10.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3670 -7.3790 -10.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 -7.7650 -11.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -6.9220 -12.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -5.6840 -12.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7590 -5.2710 -11.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -4.0380 -11.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 -3.4510 -11.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 -3.6420 -10.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -2.5500 -10.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 -4.8680 -13.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0990 -5.3560 -14.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 -8.2070 -9.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0130 -9.4670 -9.2510 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 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 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 -1.4180 -1.6240 0.0070 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 2.5450 0.4900 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -0.2980 -2.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -2.3630 -3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -1.5710 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -2.8880 -5.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -2.2570 -7.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -3.7080 -6.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -4.8270 -7.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -3.3760 -7.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -6.3120 -8.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4800 -8.7290 -11.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 -7.2370 -13.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 -5.5510 -14.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 -6.2780 -14.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 -4.6100 -15.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5470 -10.0300 -10.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0650 -9.3040 -9.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9290 -10.0300 -8.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 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 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 21 22 2 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 28 29 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END