IBS-ZINC04674579 MOE2007 3D Structure written by MMmdl. 57 60 0 0 0 0 0 0 0 0999 V2000 -2.6160 -2.0320 8.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 -0.8880 7.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -0.7580 5.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8590 0.3950 5.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 0.5330 3.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 -0.1680 2.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -0.0550 1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 0.7540 1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 1.4480 2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 1.3380 3.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 0.8490 0.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 1.6270 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 1.1150 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 1.9950 -0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 3.3360 -0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 3.8360 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 3.0120 -0.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 3.8170 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 3.5350 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 4.6350 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 5.9610 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 6.2500 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 5.1530 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 4.2870 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3140 5.1140 -0.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 1.3610 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -0.3900 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -1.0780 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -1.9020 -1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -2.9860 7.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -1.8740 8.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 -2.1060 9.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 0.0460 7.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1900 -1.0600 7.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 -1.6990 5.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -0.5960 6.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 1.3380 5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 0.2410 4.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3480 -0.8090 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -0.6130 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 2.0830 2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 1.8830 4.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 0.2420 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 2.5260 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 4.4560 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 6.7790 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 7.2650 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2950 0.7830 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0290 0.7100 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8140 2.0940 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -0.6000 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 -0.8620 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -0.9190 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 -2.3860 -2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 -2.1210 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 5.1050 -0.2180 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3550 5.9200 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 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 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 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 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 56 2 0 0 0 0 17 18 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 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 56 1 0 0 0 0 24 25 3 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END