KEYORGANICS-ZINC01402343 MOE2007 3D Structure written by MMmdl. 37 40 0 0 0 0 0 0 0 0999 V2000 0.9190 6.6100 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 5.3110 0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 4.2870 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 4.5560 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 5.8740 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 6.8910 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 3.5450 -0.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 2.1510 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 1.6710 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6860 2.8010 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 3.9250 -0.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.3710 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 1.5060 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 0.7740 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.1030 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -0.2690 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 0.4660 0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -0.8540 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 -1.6160 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9070 -2.1310 0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -0.9190 -0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 7.4050 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 5.0980 1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 3.3090 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 6.1270 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 7.9050 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 0.6340 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7440 2.8530 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 2.1930 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 0.9400 -1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -0.9610 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 0.3360 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -1.6940 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -2.7580 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -0.4620 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 -1.6820 -0.5500 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0090 -1.8930 -1.0890 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 20 36 1 0 0 0 0 21 35 1 0 0 0 0 21 36 2 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 36 1 M END