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CnQuest " * 1 * =" =, E " # * * ) * 8, * ) =" + 8 " 5 CDED4--- " F" G ) * " # * " " * ) G * ) G " (# * ) Cambridge Crystallgraphic Data Centre http://www.ccdc.cam.ac.uk/ Cambridge Crystallgraphic Data Centre #DOXSIS 3387048 16 9 0 0 0 4 4 8 0 0 301300000010000000000086 137050 HEADER 99740 84360 CSD ENTRY 90 DOXSIS 90 90444000 0 0 0 0 0 0 0168 19P111 440 R=0.0180 COMPND NICOTINE MONOHYDROGEN IODIDE 11 011 CRYST 011 011 13.705 6101 9.974 6110 0011 8.436 011 6110 90.00 6011 90.00 6101 90.00 011 6 P111 C 68H ATOM 3I 140N 1 I1 68 NICO 1 1.583 1.561 0.355 1.00 0.00 I1 ATOM 11550 15650 N1 NICO 410 N1 1 39070 5.355-53910 -5.377 11530 10.5 C1 1.00 41910-410 0.00 1190 C ATOM 390-3350 3 C1 106130 NICO C3 1 33370 5.744-39370 -4.111 9460 10.057 C4 1.00 30500-5630 0.00 9660 C5 ATOM 33450-59370 4 C 11070 NICO C6 1 4610 5.375-19100 -3.343 105490 8.953 C7 1.00 34670 0.00-8430 103700 C8 ATOM 39850 3750 5 C3 96340 NICO C9 1 49810 4.573-150 -3.97 90740 7.98 N 1.00 49050-16310 0.00 9160 C10 ATOM 58640-3330 6 C4 91710 NICO H1 1 45630 4.180-37430 -5.49 17800 8.151 H 1.00 3010-34830 0.00 84940 H3 ATOM 7050-56910 7 C5 88930 NICO H4 1 31160 4.584-69540 -5.9 111430 9.30 H5 1.00 46660-17710 0.00 114730 H6 ATOM 9460-1150 8 C6 9790 NICO H7 1 3110 5.840-6480 -1.905 114010 8.899 H8 1.00 36550 0.00 6990 88960 H9 ATOM 41090 10990 9 C7 105490 NICO H10 1 51390 4.75 1190-0.841 8000 8.748 H11 1.00 54700 0.00 1150 9780 H1 ATOM 45690-18690 10 C8 8150 NICO H13 1 61800 5.461-070 0.374 1000 8.17 H14 1.00 57540 0.00-3340 940 H15 ATOM 61740-1060 11 C9 83660 NICO 1 6.86-0.15 7.655 1.00 0.00 0 3 ATOM 4 5 6 7 1 4 8 N 910 NICO 81 3 5 1 6 7 8 9 6.7 9101011111131313111-1.67 7.699 1.00 0.00... CONECT 1 0 CONECT 3 7 CONECT 3 4 14... MASTER 0 0 0 0 0 0 0 0 8 0 8 0 END
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