./dpa3.pdb OpenBabel11132113523D 36 36 0 0 1 0 0 0 0 0999 V2000 -0.5430 1.3500 0.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 0.0690 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -0.0700 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 0.7250 0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -1.0330 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -1.1090 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9590 -0.1980 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 -2.1270 0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 -0.3070 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3250 -2.2370 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 -1.3260 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -1.1670 1.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -1.5720 1.4450 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9260 -2.1550 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -2.5850 -0.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -2.4940 2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 -2.1810 0.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 2.2340 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 3.5680 0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 2.0420 2.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 1.6780 -0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -2.0090 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 0.5800 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -2.8310 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9080 0.3910 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 -3.0210 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 -1.4090 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 -1.7880 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 -0.6720 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3280 -2.7740 2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8880 -2.0000 3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 -3.4110 2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6380 -2.5510 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 3.9850 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 3.4350 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 4.2890 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 5 2 0 0 0 0 3 4 2 0 0 0 0 3 12 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 8 10 2 0 0 0 0 8 24 1 0 0 0 0 9 11 2 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 29 1 1 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 M END > 4 COMPLIES WITH FORMAT V. 3.0, 1-DEC-2006 888 888 WRITTEN BY MAESTRO (A PRODUCT OF SCHRODINGER, LLC) > dpa3_f > <MODEL> 1 $$$$