PUBCHEM-ZINC04774663 MOE2007 3D Structure written by MMmdl. 45 48 0 0 0 0 0 0 0 0999 V2000 7.5500 7.6660 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4230 6.6520 -0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 7.3030 -0.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 6.5570 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 7.2480 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 6.6020 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 5.2510 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 4.5670 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 5.2100 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 4.6550 -0.9740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 3.5490 -0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 2.8630 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 1.6160 -0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 1.0390 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 1.7380 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 3.0160 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 3.7940 1.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 5.0100 1.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 3.1330 3.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 3.8420 4.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 3.2090 5.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.8680 5.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 1.1610 4.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 1.7980 3.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 1.0760 2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -0.0700 2.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 3.4800 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 4.6770 -2.5950 O 0 5 0 0 0 0 0 0 0 0 0 0 7.3470 8.5210 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5020 7.2150 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6450 8.0580 -1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3400 6.2910 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6440 5.8170 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9770 8.2980 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 7.1640 -1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 3.5120 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 4.6250 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 5.0490 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 1.0860 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 0.0540 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 4.8860 3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 3.7610 5.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 1.3740 6.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 0.1190 4.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 2.7780 -3.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 27 28 1 0 0 0 0 27 45 2 0 0 0 0 M CHG 1 28 -1 M END