IBS-ZINC02217715 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 0 0 0 0 0 0999 V2000 -0.3230 1.9330 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 0.4220 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -0.2290 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -0.2450 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -1.2490 -1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 -1.8320 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -1.3970 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4180 -1.6830 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6970 -0.8730 1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9400 -0.8950 2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8420 -1.7620 1.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4940 -2.5230 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3190 -2.5500 -0.1840 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3060 -0.1170 3.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7370 -0.0040 3.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0200 0.2250 4.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6860 0.9160 5.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3180 0.6810 3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4860 1.6990 6.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -0.0940 1.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -0.4210 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 0.1770 0.8480 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 -2.9120 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -2.8890 -3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -2.8440 -2.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -1.6770 -2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 -4.2120 -4.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 -1.7350 -4.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 2.4000 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 2.4030 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 2.1680 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 0.3040 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -0.1070 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -1.3030 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 0.2170 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2600 -3.1940 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1440 0.8350 2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3020 -0.8970 3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0610 0.5330 5.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8200 -0.6760 5.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5510 0.0030 5.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0710 1.7160 5.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 0.1910 3.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2020 1.6470 3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3410 0.8260 7.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5290 2.0250 6.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8350 2.5230 7.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -3.8660 -1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -2.8320 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -0.8570 -2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -1.9130 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 -4.3620 -4.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -4.2400 -4.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -5.0640 -3.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -0.7580 -3.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 -1.6980 -5.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 -1.8480 -4.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1340 1.3270 5.5000 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.2780 2.1610 4.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 22 2 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 21 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 58 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END