IBS-ZINC04194001 MOE2007 3D Structure written by MMmdl. 53 56 0 0 1 0 0 0 0 0999 V2000 -8.7840 11.0050 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5980 10.1560 0.5660 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.9580 9.1850 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8770 10.8660 1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7110 10.0010 2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7190 9.8000 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 9.2540 -0.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6250 9.9600 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0070 8.1250 -0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6560 7.6350 -1.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7530 7.4840 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 8.2330 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 7.6410 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 6.2880 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 5.5160 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7390 6.1150 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8950 5.3680 -0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7710 5.6130 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0080 4.7190 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6160 3.3490 1.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 4.0850 0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 3.4200 0.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 3.4560 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 2.1020 1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 1.5230 1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 2.2790 2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 3.6240 1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 4.2240 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 5.6600 1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 6.3250 1.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2960 10.5000 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4770 11.1440 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4250 11.9760 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4970 11.8260 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5740 11.0280 2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 10.4960 3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0880 9.0320 2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9410 9.1030 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2710 10.7580 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3350 10.9310 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1040 9.3680 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 9.2830 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 8.2310 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3790 5.5520 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 5.3860 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0780 6.6590 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6990 4.9630 1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4980 4.8820 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 2.7230 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 1.5060 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 0.4740 2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 1.8150 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 4.2090 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 M END