IBS-ZINC04082061 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 -0.4790 1.3580 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -0.1260 0.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2220 -0.6420 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.7520 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -0.7020 2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -1.5130 3.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 -1.8620 3.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -0.3400 -1.1360 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2120 0.1390 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -1.8440 -1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -1.9980 -2.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.5680 -3.4880 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0230 -0.1680 -3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 0.1820 -2.3160 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5320 1.6960 -2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 2.0600 -4.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 1.0840 -5.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2350 1.0810 -4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 -0.3750 -4.8670 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5460 -1.0440 -4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -0.8230 -6.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3450 -1.9180 -5.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -0.3830 -7.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 1.1240 -7.4480 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4980 1.6450 -7.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 1.5190 -6.4900 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7890 3.0510 -6.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 3.5180 -8.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 3.0600 -9.0300 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3120 3.2670 -10.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 1.5710 -8.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 3.8320 -8.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 3.6940 -7.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 0.8070 -6.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -0.3740 -5.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 0.5790 -5.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -0.2180 -2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 1.9290 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 1.8000 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 1.5040 1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -1.8030 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -0.2490 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 0.3300 3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -1.0720 2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -2.1600 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -2.4880 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -2.5210 -3.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -2.5830 -3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 2.2340 -2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 2.1120 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 3.0850 -4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 2.0850 -4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.6170 -8.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -0.9550 -7.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 3.3640 -5.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 3.5920 -6.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 3.1510 -8.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 4.6140 -8.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 1.3520 -9.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 0.9830 -9.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 1.1960 -6.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1590 0.9470 -7.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 -0.2720 -6.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 0.3870 -1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 -0.0910 -2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 -1.2660 -1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -1.7240 4.8900 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 6 7 2 0 0 0 0 6 67 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 26 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 23 1 0 0 0 0 21 35 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 26 34 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 34 61 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 35 36 1 0 0 0 0 37 64 1 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 M CHG 1 67 -1 M END