./dpa42.pdb OpenBabel11132113523D 40 40 0 0 1 0 0 0 0 0999 V2000 0.7460 0.2660 4.7330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 1.6120 4.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.9910 3.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 3.0810 3.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 2.4800 5.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 3.8630 5.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 4.0420 5.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 4.9650 5.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 5.3230 6.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 6.2460 5.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 6.4250 6.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 0.9920 3.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 1.0370 2.0120 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0850 0.7920 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 0.1160 0.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7550 -0.0210 2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 0.2240 3.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 1.1110 3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8230 -1.0840 4.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 1.4490 -0.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -0.3620 5.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -0.0590 3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 2.2070 6.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 3.1840 5.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 4.8250 5.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 5.4620 6.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 7.1030 6.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 7.4220 6.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 0.0810 3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 2.0170 2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5160 0.0130 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 -1.0010 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 0.7070 4.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3080 0.6270 2.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2790 2.0610 3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0550 1.2890 4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5400 -1.5670 3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2870 -0.9060 5.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 -1.7290 4.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 1.2870 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 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 23 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 24 1 0 0 0 0 8 10 2 0 0 0 0 8 25 1 0 0 0 0 9 11 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 30 1 1 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 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) > dpa42 > <MODEL> 1 $$$$