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American Mineralogist Crystal Structure Database

1 matching records for this search.

Ylid
  
Christensen A T, Thom E
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=27&spage=581 
Acta Crystallographica B27 (1971) 581-586
The crystal structure of 2-dimenthylsulfuranylidene-1,3-indanedione
_database_code_amcsd 0009387
18.331 9.012 5.949 90 90 90 P2_12_12_1
atom       x       y      z Biso B(1,1) B(2,2) B(3,3)  B(1,2)  B(1,3)  B(2,3)
C1    .10008 -.05523 .18330      .00230 .00917 .02048 -.00018 -.00039 -.00088
C2    .07783 -.12614 .38522      .00204 .00901 .02091  .00034  .00068  .00014
C3    .12478 -.24872 .43920      .00209 .00803 .02521 -.00010 -.00009 -.00069
C4    .18203 -.24824 .26019      .00206 .00797 .02790 -.00025  .00043 -.00144
C5    .24261 -.33758 .23448      .00226 .01006 .03927  .00027  .00100 -.00065
C6    .28770 -.31158 .05134      .00245 .01209 .04930 -.00013  .00321 -.00578
C7    .27250 -.20004 .89875      .00294 .01357 .03581 -.00063  .00394 -.00410
C8    .21165 -.10923 .92521      .00282 .01231 .02557 -.00034  .00194 -.00153
C9    .16740 -.13548 .10749      .00215 .00905 .02189 -.00066  .00050 -.00251
O10   .07282  .05253 .08495      .00342 .01228 .02408  .00142  .00055  .00405
O11   .12074 -.33904 .59239      .00320 .01089 .03242  .00089  .00162  .00559
S12   .00963 -.06841 .55985      .00222 .00791 .02098  .00043  .00142  .00181
C13  -.07276 -.07369 .40039      .00227 .01419 .04838  .00015 -.00130 -.00289
C14   .02129  .12778 .58522      .00392 .00849 .02839 -.00001  .00204 -.00326
H15   .19930 -.03881 .80885 2.60
H16   .30718 -.19207 .75411 4.05
H17   .33384 -.37029 .02650 2.08
H18   .25517 -.41118 .35533 4.39
H19   .02535  .16566 .42299 2.21
H20   .07654  .14432 .68686 3.27
H21  -.02535  .16008 .67677 1.54
H22  -.08700 -.16705 .36148 3.44
H23  -.11177 -.03064 .51986 6.11
H24  -.06271 -.03427 .24319 2.45


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	Total number of retrieved datasets: 1

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