IFLAB-ZINC04076936 MOE2007 3D Structure written by MMmdl. 38 41 0 0 0 0 0 0 0 0999 V2000 0.4170 1.2430 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 2.0500 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 3.4060 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 3.9560 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 3.1510 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 1.7900 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 3.7280 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3070 3.0080 -0.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 5.1780 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 5.7090 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 7.0790 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 7.9220 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 7.4130 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 6.0120 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 5.3830 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 6.0090 0.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 8.2850 0.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 9.5710 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 10.1220 1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 11.4170 2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 12.1800 1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 11.6480 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 10.3460 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 9.7840 -1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 8.5570 -1.4090 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.4890 7.7400 0.4290 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 0.1860 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 1.6280 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 4.0300 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 1.1500 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 5.0570 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 8.9960 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 7.9530 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 9.5370 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 11.8250 2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 13.1870 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 12.2500 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 10.5640 -1.6820 O 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 38 2 0 0 0 0 M CHG 1 25 -1 M END