KEYORGANICS-ZINC04024185 MOE2007 3D Structure written by MMmdl. 60 64 0 0 0 0 0 0 0 0999 V2000 0.2040 0.5530 6.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 1.7950 5.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 2.7830 6.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 3.9270 5.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 4.1070 4.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 3.1030 3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 1.9570 4.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 3.2050 2.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 1.3960 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 1.1480 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.6790 -1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 3.1670 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 3.4080 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 1.4220 -2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 1.8440 -3.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 1.3340 -4.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 0.6870 -4.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 0.2080 -5.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 0.7130 -3.5770 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 1.4410 -5.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9910 2.7180 -5.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 2.8920 -6.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 1.7920 -7.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 0.5040 -6.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 0.3080 -5.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 -1.0110 -5.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -2.0870 -5.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 -1.8780 -6.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2020 -0.5910 -7.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 5.3750 3.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -0.2180 6.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 0.7590 7.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 0.1670 6.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 2.6740 6.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 4.6850 5.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 1.1740 4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 4.2260 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 2.5420 2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 0.8570 1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 1.0910 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 0.0720 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 1.6240 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 1.1400 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 3.7580 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 3.5360 -1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 4.4820 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 2.9090 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 2.4320 -2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 3.5870 -5.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 3.8830 -7.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 1.9510 -7.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -1.2180 -4.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 -3.0880 -5.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 -2.7120 -7.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9820 -0.4480 -7.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 5.9040 3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 6.0610 3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 5.1550 2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 2.8710 1.3420 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1420 3.3610 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 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 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 59 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 9 59 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 13 59 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 48 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 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END