ENAMINE-ZINC05071545 MOE2007 3D Structure written by MMmdl. 47 49 0 0 0 0 0 0 0 0999 V2000 3.9100 9.7680 1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 10.2720 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 9.4540 -0.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8620 9.6520 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5260 10.5910 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9230 10.4860 0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5990 9.4800 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9360 8.5400 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5540 8.6620 -0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 8.3960 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 7.6490 -1.6780 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 6.1800 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 5.3480 -0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 4.1000 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 3.3810 -0.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 2.2160 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 1.5550 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 0.3550 0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -0.1810 1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 0.4610 1.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 1.6630 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -1.3330 2.1670 F 0 0 0 0 0 0 0 0 0 0 0 0 11.4060 9.4140 0.1920 S 0 0 0 0 0 0 0 0 0 0 0 0 11.7520 8.7720 -1.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7610 10.8270 0.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7280 8.5520 1.4870 N 0 5 0 0 0 0 0 0 0 0 0 0 11.4100 7.6240 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 8.7410 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 9.7770 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 10.3980 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7440 11.3080 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 10.2790 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9950 11.3550 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4960 11.1910 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4520 7.7710 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 6.4990 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 5.5900 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 5.0410 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 5.9380 -0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 4.3970 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 3.4810 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 1.9790 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -0.1590 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 0.0240 2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 2.1380 1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5970 7.9250 -1.3680 N 0 3 0 0 0 0 0 0 0 0 0 0 6.7690 7.1390 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 46 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 26 -1 M CHG 1 46 1 M END