KEYORGANICS-ZINC01399729 MOE2007 3D Structure written by MMmdl. 51 54 0 0 0 0 0 0 0 0999 V2000 -8.6420 10.0830 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4520 10.2010 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4110 11.0260 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5870 11.7300 1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7750 11.6010 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8030 10.7840 1.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9270 12.2750 3.5450 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.1250 11.1390 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 9.9260 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 8.6460 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 8.4660 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 8.4990 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 9.7780 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 7.2210 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 5.8700 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 5.1190 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 6.0450 0.5640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 5.8730 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 7.3200 0.5490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 3.6750 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 2.7950 0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 1.4140 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 0.8930 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 1.7480 -0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 3.1370 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 1.1980 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 -0.1260 -1.0780 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 1.8320 -1.8960 F 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 1.3270 0.1280 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.4430 9.4460 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3550 9.6490 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8130 12.3830 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7220 10.7020 2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 12.0140 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3620 11.2520 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 10.8170 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 9.9950 -2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 8.6760 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 7.7890 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 9.3260 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 7.6330 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 8.4230 2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 10.6670 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4670 9.7350 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 5.4920 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 3.1740 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 0.7440 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -0.1860 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 3.7940 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2200 9.9220 -0.1570 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.8200 9.1030 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 50 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 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 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 49 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 50 51 1 0 0 0 0 M CHG 1 50 1 M END