CHEMDIV-ZINC04913750 MOE2007 3D Structure written by MMmdl. 48 51 0 0 0 0 0 0 0 0999 V2000 -0.2240 -1.5740 5.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -1.1140 4.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -1.9260 3.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -1.5130 1.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -0.2790 1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 0.5160 2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 0.1030 3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 0.1180 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 1.5560 -0.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 2.2440 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 1.8630 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 2.7970 0.6420 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 4.0840 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 4.5500 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 3.5750 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 2.4340 -0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 2.1430 -1.1680 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 2.6790 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9650 2.5680 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6270 1.3800 0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0130 1.2740 0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7600 2.3470 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1030 3.5360 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7170 3.6440 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2510 2.2430 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -2.1450 5.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -0.7210 6.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -2.2050 5.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -2.8910 3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -2.1740 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 1.4680 2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 0.7380 4.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -0.3990 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -0.1790 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 0.8540 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 4.7610 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 5.5770 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1930 3.7150 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 2.0710 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0700 0.5280 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5080 0.3470 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6690 4.3870 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 4.5770 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7250 2.5660 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5550 1.2130 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6210 2.8670 -1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 3.6350 -0.7420 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8690 4.4540 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 47 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 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 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END