KEYORGANICS-ZINC04025507 MOE2007 3D Structure written by MMmdl. 48 50 0 0 1 0 0 0 0 0999 V2000 1.7740 -10.0830 3.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -9.4960 2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 -8.4240 2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 -7.8090 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 -8.3030 1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -9.3660 1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 -9.9800 2.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 -11.1330 3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 -12.3340 2.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7740 -10.6950 4.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 -6.7560 0.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -5.9960 -0.5770 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4520 -5.7840 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 -6.7360 -1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 -7.3070 -2.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 -4.6460 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -3.4670 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -2.2190 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -2.1400 -1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -3.2980 -1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -4.5420 -1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -0.8290 -1.3990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -0.5740 -1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 0.7810 -1.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 0.3640 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -9.9740 4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -9.5780 3.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -11.1400 3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -8.0620 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2010 -7.8860 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9490 -9.7150 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 -11.4850 4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8390 -12.1080 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 -13.1830 3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 -12.6550 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0800 -11.5120 5.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6510 -10.4020 3.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4910 -9.8430 5.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 -6.4980 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 -3.5080 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 -1.3510 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -3.2790 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -5.4320 -1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -1.3850 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 1.4350 -2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 0.5450 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 1.3320 -1.4370 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7460 2.3280 -1.3140 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 11 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 3 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 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 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 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 24 47 1 0 0 0 0 25 46 1 0 0 0 0 25 47 2 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END