KEYORGANICS-ZINC01386029 MOE2007 3D Structure written by MMmdl. 41 44 0 0 0 0 0 0 0 0999 V2000 1.3300 -0.0070 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -0.0700 -1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 0.2410 -3.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 0.1750 -4.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -0.2100 -4.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -0.5110 -2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -0.4200 -1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -0.7460 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 -0.0690 0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 -0.6940 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4170 -2.0350 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7790 -2.2910 0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7070 -1.2550 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3190 0.0910 0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 0.3300 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9790 1.2540 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 2.2820 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 2.4510 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 3.4650 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 4.2840 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 4.1570 -1.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 3.1630 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 3.0940 -2.2880 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -0.9430 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 0.1360 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 0.8290 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 0.5320 -3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 0.4160 -5.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -0.2740 -4.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 -0.8120 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -0.4250 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -1.8300 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7090 -2.8340 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 -3.3220 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7540 -1.5070 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0220 0.8960 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 1.8030 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 3.6160 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 5.0890 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 1.5080 0.4190 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6600 2.4330 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 40 2 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END