IBS-ZINC04817730 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 -0.9030 -2.0840 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -2.2270 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -0.8630 -1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -0.7310 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -0.3280 -2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 1.2070 -2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 1.7150 -3.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 2.1270 -3.4150 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0530 1.2940 -2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1470 2.3770 -4.8230 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9310 2.3170 -5.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 1.8320 -4.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 1.5720 -5.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 2.5720 -6.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1410 1.3070 -5.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0890 0.1740 -4.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 1.6800 -6.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1030 0.8060 -6.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1240 1.0750 -7.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5290 0.0260 -8.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5130 0.2300 -9.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1100 1.4810 -9.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7310 2.5270 -8.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7460 2.3240 -7.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6850 3.3650 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 3.4430 -1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8810 4.5740 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 5.6560 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 5.5850 -1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 4.4550 -2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 6.8540 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -1.4710 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 -1.6290 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -3.0690 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -2.7040 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -2.8220 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -0.0110 -2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 -1.7870 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 -0.7000 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 0.1920 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -1.5720 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -0.6890 -2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.7680 -3.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 1.6130 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 1.5850 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 3.3660 -4.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0720 2.6620 -6.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1400 -0.1840 -6.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0760 -0.9590 -8.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8130 -0.5880 -10.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8760 1.6400 -10.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2060 3.5000 -8.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4840 3.1530 -7.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 2.6220 -1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6940 4.6080 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 6.4130 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 4.4410 -3.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 6.7100 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 7.7600 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 7.0200 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -0.8550 -1.4380 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5890 -0.2130 -0.6340 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 35 1 0 0 0 0 2 36 1 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 61 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 61 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END