ENAMINE-ZINC03431493 MOE2007 3D Structure written by MMmdl. 56 58 0 0 1 0 0 0 0 0999 V2000 0.8320 2.9580 5.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 3.3440 5.0660 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7530 4.4310 5.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 2.8280 6.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 1.9760 5.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 3.3540 7.4910 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 4.4980 7.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 5.5670 8.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 4.9810 9.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 3.7850 9.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 2.7480 8.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 3.7470 2.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 3.2420 1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 1.8410 0.9510 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 0.9080 2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 1.3820 3.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 1.2970 -0.5580 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 2.2860 -1.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 0.8850 -0.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -0.1370 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -0.0600 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -1.1530 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -2.3220 -1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 -2.3940 -1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -1.2990 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -1.4390 -1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2430 -2.4950 -2.7590 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 -1.6540 -0.8540 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -0.3560 -2.5890 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 3.4610 6.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 1.8840 5.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 3.2320 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 4.1210 8.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 4.9530 7.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 6.0140 7.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 6.3710 8.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 5.7480 10.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 4.6650 10.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7970 4.1320 8.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 3.3290 10.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 1.9210 8.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 2.3260 9.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 3.8050 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 4.7300 2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 3.9130 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 3.2670 1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 0.8730 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -0.1010 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 1.4020 3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 0.7360 4.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 0.8500 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -1.0920 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -3.1780 -1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -3.3180 -2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 2.8020 3.7100 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1980 2.7320 3.8910 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 4 1 0 0 0 0 2 55 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 55 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 16 55 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END