IBS-ZINC02099811 MOE2007 3D Structure written by MMmdl. 45 48 0 0 0 0 0 0 0 0999 V2000 -7.2820 -2.0860 4.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3040 -2.8230 3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 -1.9750 1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 -1.2820 2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 -0.4790 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9470 -0.3540 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1600 -1.0240 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6130 -1.8240 0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8190 -2.4330 0.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 0.4140 -1.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 1.0880 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 1.0730 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 0.2420 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 0.1470 2.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 1.8130 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 1.1170 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 1.8110 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 3.2050 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 3.9060 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 3.2140 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 5.2710 0.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 5.8960 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 6.0020 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 4.6350 -1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 3.8270 0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 1.8830 -2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 1.2690 -3.2210 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.8320 -1.1750 4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1900 -1.7980 3.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5760 -2.7250 4.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7490 -3.7570 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4310 -3.1300 3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 -1.3680 2.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7550 -0.9220 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0790 -2.9070 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 0.0300 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 1.2640 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 3.7750 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 5.3930 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 6.9080 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 6.6440 -1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 6.4610 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 4.1130 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 4.7770 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 3.0410 -2.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 2 0 0 0 0 M CHG 1 27 -1 M END