American Mineralogist Crystal Structure Database

9 matching records for this search.

Pretulite
Download hom/pretulite.pdf
Moelo Y, Lulzac Y, Rouer O, Palvadeau P, Gloaguen E, Leone P
Download cm/vol40/CM40_1657.pdf
The Canadian Mineralogist 40 (2002) 1657-1673
Scandium mineralogy: pretulite with scandian zircon and xenotime-(Y)
with an apatite-rich oolitic ironstone from Saint-Aubin-des-Chateaux,
Armorican Massif, France
Locality: Saint-Aubin-des-Chateaux, Armorican Massif, France
_database_code_amcsd 0005799
6.5870 6.5870 5.809 90 90 90 *I4_1/amd
0 -.25 .125
atom     x   y    z  occ Uiso
Sc       0 .75 .125 .904 .009
Y        0 .75 .125 .032 .009
Yb       0 .75 .125 .016 .009
Zr       0 .75 .125 .048 .009
P        0 .25 .375 .952 .007
Si       0 .25 .375 .048 .007
O    .1806 .75 .436      .009
Download AMC data (View Text File)
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View JMOL 3-D Structure
 
Rouxelite
 
Orlandi P, Meerschaut A, Moelo  Y, Palvadeau P, Leone P
Download cm/vol43/CM43_919.pdf
The Canadian Mineralogist 43 (2005) 919-933
Lead-antimony sulfosalts from Tuscany (Italy). VIII. Rouxelite, Cu2HgPb22Sb28S64(O,S)2,
A new sulfosalt from Buca Della Vena mine, Apuan Alps: definition and crystal structure
Locality: Buca Della Vena mine, Apuan Alps
_database_code_amcsd 0006020
43.113 4.0591 37.874 90 117.35 90 C2/m
atom     x    y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Hg       0    0     0      .032   .036   .031   .029      0   .013      0
Cu   .0792    0 .1719      .030
Pb1  .4860    0 .0926      .029   .030   .020   .034      0   .012      0
Pb2  .3853    0 .0914      .028   .026   .022   .036      0   .014      0
Pb3  .2942    0 .0992      .034   .040   .029   .034      0   .018      0
Pb4  .2607    0 .1923      .033   .032   .025   .048      0   .023      0
Pb5  .1566    0 .1858      .035   .028   .037   .040      0   .014      0
Pb6  .2466    0 .3051      .035   .036   .029   .038      0   .015      0
Pb7  .3149    0 .4278      .029   .025   .028   .036      0   .015      0
Pb8  .3968    0 .5500      .033   .025   .036   .038      0   .015      0
Pb9  .5208    0 .3187      .034   .042   .030   .037      0   .023      0
Sb1  .0977    0 .9955      .028   .021   .033   .027      0   .009      0
Sb2  .1971    0 .0028      .033   .035   .028   .032      0   .011      0
Sb3  .1779   .5 .0957      .026   .029   .027   .022      0   .010      0
Sb4  .0799   .5 .0851      .030   .030   .030   .031      0   .014      0
Sb5  .1473   .5 .2825      .032   .024   .053   .020      0   .010      0
Sb6  .2213   .5 .3940      .021   .011   .022   .032      0   .011      0
Sb7  .3021   .5 .5162      .044   .046   .030   .081      0   .049      0
Sb8  .3816   .5 .6377      .034   .034   .040   .036      0   .023      0
Sb9  .4584 .083 .4991   .5 .037   .029   .040   .040  -.003   .015  -.010
Sb10 .3309   .5 .3008      .059   .024   .044   .084      0   .004      0
Sb11 .3526   .5 .2019      .052   .034   .034   .064      0   .001      0
Sb12 .4466   .5 .2121      .041   .029   .058   .034      0   .013      0
Pb13 .3925   .5 .3991  .78 .050   .042   .059   .060      0   .032      0
Sb13 .3925   .5 .3991  .22 .050   .042   .059   .060      0   .032      0
Pb14 .4827    0 .4031  .50 .047
Sb14 .4778 .112 .4002  .25 .047
Pb15 .4145   .5 .3003 .574 .045
Sb15 .4270 .467 .3020 .213 .045
Pb16 .5394    0 .2216 .452 .023
Sb16 .5258    0 .2058 .548 .023
S1   .1459   .5 .9943      .059
S2   .0557   .5 .9917      .042
S3   .0247    0 .0706      .022
S4   .1223    0 .0930      .030
S5   .2145    0 .0962      .029
S6   .1994   .5  .167      .033
S7   .2687   .5 .2582      .018
S8   .1881   .5 .2543      .013
S9   .0981   .5 .1573      .030
S10  .1101    0 .2432      .036
S11  .1900    0 .3435      .045
S12  .2701   .5 .3738      .016
S13  .2643    0 .4573      .037
S14  .3469   .5 .4939      .032
S15  .3386    0 .5728      .038
S16  .4114    0 .6853      .035
S17  .4255   .5 .6138      .023
S18  .4487   .5 .5414      .046
S19  .3959    0 .4512      .041
S20  .4616   .5 .4444      .020
S21  .3241    0 .3452      .031
S22  .4141    0 .3554      .034
S23  .4820   .5 .3549      .038
S24  .3384    0 .2471      .038
S25  .4375    0 .2666      .054
S26  .5113   .5 .2607      .028
S27  .2915   .5 .1551      .024
S28  .3623    0 .1592      .027
S29  .4577    0 .1738      .035
S30  .5240   .5 .1629      .031
S31  .3292   .5 .0719      .022
S32  .4298   .5 .0776      .021
S33   .234   .5  .018  .33 .034
O33   .205   .5  .006  .67 .034
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Scainiite
 
Moelo Y, Meerschaut A, Orlandi P, Palvadeau P
 
European Journal of Mineralogy 12 (2000) 835-846
Lead-antimony sulfosalts from Tuscany (Italy):
II - Crystal structure of scainiite, Pb14Sb30S54O5,
an expanded monoclinic derivative of Ba12Bi24S48
hexagonal sub-type (zinkenite group)
Locality: Tuscany, Italy
_database_code_amcsd 0006839
51.996 8.148 24.311 90 104.09 90 C2/m
atom     x     y     z occ Uiso
Pb1  .0865     0 .5547 1/3 .047
Sb1  .0865     0 .5547 2/3 .047
Pb2  .0889   1/2 .5547 2/3 .037
Sb2  .0889   1/2 .5547 1/3 .037
Pb3  .1450     0 .4616 2/3 .031
Sb3  .1450     0 .4616 1/3 .031
Pb4  .1469   1/2 .4659 1/3 .030
Sb4  .1469   1/2 .4659 2/3 .030
Pb5  .1044     0 .7367     .030
Sb5  .1032   1/2 .7553     .028
Sb6  .5281     0 .8069     .018
Pb6  .5363   1/2 .8044     .027
Pb7  .3592     0 .8647     .033
Pb8  .3586   1/2 .8694     .028
Pb9  .3201     0 .6790     .029
Pb10 .3177   1/2 .6780     .028
Pb11 .2717     0 .8101     .030
Pb12 .2701   1/2 .8049     .034
Pb13 .4141     0 .0298     .023
Pb14 .4120   1/2 .0279     .030
Pb15 .1874     0 .7808     .031
Pb16 .1878   1/2 .7805     .027
Sb7  .1478 .2335 .8861     .041
Sb8  .2331 .2626 .9228     .043
Sb9  .3152 .2401 .9656     .041
Sb10 .2437 .2428 .6479     .045
Sb11 .2851 .2583 .5217     .053
Sb12 .3283 .2428 .3801     .030
Sb13 .3916 .2556 .7405     .029
Sb14 .4361 .2427 .8998     .039
Sb15 .4863 .2617 .0644     .038
Sb16 .4598 .2517 .7580     .025
Sb17 .4349     0 .6379     .020
Sb18 .4385   1/2 .6402     .023
Sb19 .4759 .2375 .5412     .050
Sb20 .4554 .2799 .3482     .029
O1   .4487     0 .7224     .045
O2   .4557   1/2 .7311     .003
O3   .4500   1/2 .3133     .005
O4   .4422 .2560 .6719     .047
S1   .1483     0 .6519     .025
S2   .1492   1/2 .6594     .036
S3   .2664     0 .5838     .028
S4   .2701   1/2 .5830     .034
S5   .1899     0 .9001     .027
S6   .1930   1/2 .9032     .032
S7   .4809     0 .6180     .013
S8   .4828   1/2 .6206     .036
S9   .1930     0 .5360     .019
S10  .1928   1/2 .5378     .037
S11  .2268     0 .6973     .020
S12  .2248   1/2 .6990     .029
S13  .1124     0 .8630     .017
S14  .1113   1/2 .8614     .039
S15  .5340     0 .5438     .025
S16  .5357   1/2 .5499     .026
S17  .2720     0 .9380     .038
S18  .2685   1/2 .9387     .027
S19  .3788     0 .6708     .040
S20  .3794   1/2 .6734     .025
S21  .3476     0 .9863     .022
S22  .3512   1/2 .9863     .026
S23  .4139     0 .8305     .036
S24  .4143   1/2 .8309     .031
S25  .5080     0 .1397     .030
S26  .5060   1/2 .1361     .022
S27  .4585     0 .9827     .035
S28  .4609   1/2 .9865     .034
S29  .3275 .2495 .5915     .024
S30  .3143 .2505 .8657     .025
S31  .3506 .2524 .7686     .020
S32  .4472 .2479 .1020     .020
S33  .2315 .2479 .8227     .025
S34  .2848 .2477 .7201     .020
S35  .3971 .2522 .9397     .024
S36  .1337 .2512 .5328     .029
S37  .0887 .2452 .6347     .028
S38  .0713 .2431 .4687     .023
S39  .3515 .2527 .2142     .024
S40  .4308 .2158 .2427     .023
S41  .4957 .2319 .2575     .021
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Pillaite
Download hom/pillaite.pdf
Meerschaut A, Palvadeau P, Moello Y, Orlandi P
 
European Journal of Mineralogy 13 (2001) 779-790
Lead-antimony sulfosalts from Tuscany (Italy). IV. Crystal structure of pillaite,
Pb9Sb10S23ClO0.5, an expanded monoclinic derivative of hexagonal Bi(Bi2S3)9I3,
from the zinkenite group
Locality: Buca della Vena mine, Tuscany, Italy
Note: changed Pb2(z) to 0.2572 to match reported bond distances
_database_code_amcsd 0006897
49.49 4.1259 21.828 90 99.62 90 C2/m
atom      x     y      z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb1   .0753    .5  .2533     .028   .023   .025   .035      0  -.002      0
Pb2  -.0073    .5  .2572     .032   .021   .024   .047      0  -.001      0
Pb3  -.0897    .5  .3052     .025   .023   .028   .024      0   .004      0
Pb4   .3257     0  .3454     .032   .028   .034   .035      0   .011      0
Pb5   .3406     0  .1496     .025   .023   .030   .021      0   .003      0
Pb6   .1466    .5  .0433     .030   .033   .030   .022      0  -.007      0
Pb7  -.0749    .5  .1004     .030   .027   .034   .029      0   .000      0
Pb8   .2897     0  .4972 .75 .037   .052   .033   .028      0   .008      0
Sb8   .2897     0  .4972 .25 .037   .052   .033   .028      0   .008      0
Pb9   .2436    .5  .3440 .75 .042   .062   .033   .034      0   .020      0
Sb9   .2436    .5  .3440 .25 .042   .062   .033   .034      0   .020      0
Pb10  .1579    .5  .2470 1/3 .033   .027   .024   .053      0   .027      0
Sb10  .1579    .5  .2470 2/3 .033   .027   .024   .053      0   .027      0
Pb11  .1327     0  .3915 1/3 .038   .035   .036   .041      0   .003      0
Sb11  .1327     0  .3915 2/3 .038   .035   .036   .041      0   .003      0
Sb    .0493     0  .4032     .037   .050   .033   .023      0  -.007      0
Sb1  -.0307     0  .4246     .040   .062   .032   .022      0  -.008      0
Sb2   .8890     0  .4602     .039   .029   .064   .021      0  -.007      0
Sb3   .2741    .5  .1902     .029   .017   .027   .045      0   .010      0
Sb4   .2853    .5  .0135     .026   .018   .033   .027      0   .004      0
Sb5   .2083     0  .1711     .035   .014   .068   .023      0  -.001      0
Sb6  -.0031 .0571  .0874  .5 .036   .037   .044   .031  -.008   .016  -.012
Sb7  -.0708 .0675 -.0655  .5 .044   .028   .072   .037   .014   .015   .006
S1    .1658    .5  .3748     .029
S2    .0852    .5  .3901     .032
S3    .0081    .5  .4114     .046
S4   -.0689    .5  .4365     .036
S5    .3559     0  .4729     .025
S6    .2971    .5  .4076     .026
S7    .2670     0  .2729     .039
S8    .2816     0  .1085     .025
S9    .2894     0 -.0626     .030
S10   .1960     0  .2782     .042
S11   .2366     0  .4339     .027
S12   .1165     0  .2730     .024
S13   .0349     0  .2891     .021
S14  -.0460     0  .3134     .023
S15   .8750     0  .3489     .022
S16   .3225    .5  .2309     .024
S17   .3346    .5  .0506     .027
S18   .1589     0  .1348     .024
S19  -.0997    .5  .8745     .025
S20  -.0385    .5  .0175     .028
S21   .0236    .5  .1520     .027
S22  -.0354     0  .1606     .025
S23   .8993     0  .0125     .019
Cl    .3915    .5  .1860     .030
O     .2092    .5  .2080  .5 .037
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Moeloite
 
Orlandi P, Meerschaut A, Palvadeau P, Merlino S
 
European Journal of Mineralogy 14 (2002) 599-606
Lead-antimony sulfosalts from Tuscany (Italy). V. Definition and crystal
structure of moeloite, Pb6Sb6S14(S3), a new mineral from the Ceragiola
marble quarry
Locality: Tuscany, Italy
_database_code_amcsd 0006941
15.328 4.0400 23.054 90 90 90 P2_122_1
atom      x      y     z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb1   .0807      0 .1261 .029   .051   .008   .028  -.001  -.003   .005
Pb2   .1820 -.0012 .2950 .022   .032   .011   .024   .002   .001   .000
Pb3   .3028 -.0010 .4617 .021   .024   .010   .029   .004  -.004   .001
Sb1   .1751  .5100 .6037 .063   .018   .131   .039  -.017   .008  -.020
Sb2   .0645  .5110 .4304 .070   .014   .168   .028   .019   .001  -.042
Sb3  -.0605  .5400 .2563 .054   .025   .076   .061   .053   .015   .009
S1    .0907  .4960 .2220 .015
S2    .2306 -.0280 .6682 .031
S3    .2065  .5230 .3849 .015
S4    .3122  .5060 .5528 .015
S5   -.0456  .4890 .0699 .017
S6    .1216  .0060 .5066 .030
S7    .0173  .0090 .3510 .025
S8   -.1015 -.0340 .1885 .032
S9        0  .2380     0 .023
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Pellouxite
 
Palvadeau P, Meerschaut A, Orlandi P, Moelo Y
 
European Journal of Mineralogy 16 (2004) 845-855
Lead-antimony sulfosalts from Tuscany (Italy). VII. Crystal structure of
pellouxite, ~ (Cu,Ag)2Pb21Sb23S55ClO, an expanded monoclinic derivative
of Ba12Bi24S48 hexagonal sub-type (zinkenite group)
Locality: Tuscany, Italy
_database_code_amcsd 0007082
55.824 4.0892 24.128 90 113.14 90 C2/m
atom      x     y      z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Cu1   .1382     0  .1842 .68 .043   .055   .055   .026      0   .024      0
Ag1   .1473     0  .1853 .26 .043   .055   .055   .026      0   .024      0
Pb1   .1054     0  .2782     .028   .032   .026   .031      0   .017      0
Pb2   .1074     0  .6028     .023   .027   .026   .016      0   .008      0
Pb3  -.0640     0  .1252     .030   .025   .044   .024      0   .011      0
Pb4   .2736    .5  .2089     .023   .030   .019   .026      0   .018      0
Pb5   .0179     0  .2220     .029   .024   .032   .025      0   .002      0
Pb6   .1860    .5  .1508     .037   .033   .044   .034      0   .013      0
Pb7   .0703     0  .4149     .031   .050   .027   .018      0   .014      0
Pb8   .2476    .5  .3508     .035   .040   .041   .029      0   .017      0
Pb9   .1449     0 -.0372     .035   .020   .032   .048      0   .007      0
Pb10  .1495     0  .7864  .5 .024   .015   .025   .021      0  -.004      0
Sb10  .1427     0  .7911  .5 .024   .015   .025   .021      0  -.004      0
Pb11  .1027 .5390  .0524 .22 .031   .030   .051   .012  -.015   .008  -.011
Sb11  .0994 .5680  .0389 .28 .031   .030   .051   .012  -.015   .008  -.011
Pb12  .2853     0  .5191  .5 .042   .052   .057   .032      0   .032      0
Sb12  .2850     0  .5052  .5 .042   .052   .057   .032      0   .032      0
Sb1   .1805    .5  .6182     .025   .020   .034   .022      0   .011      0
Sb2   .1426    .5  .4496     .039   .021   .063   .024      0  -.001      0
Sb3   .2214     0  .0544     .029   .025   .036   .015      0  -.002      0
Sb4   .0774    .5  .7161     .038   .025   .058   .033      0   .015      0
Sb5   .0367    .5  .5258     .038   .030   .044   .050      0   .026      0
Sb6  -.0066    .5  .3436     .031   .026   .045   .028      0   .019      0
Sb7   .2992 .0540  .0877  .5 .016   .023   .010   .012  -.007   .005  -.002
Sb8   .0566 .5770  .1208  .5 .022   .020   .031   .016  -.007   .008  -.006
Sb9  -.0201 .5838  .0490  .5 .026   .023   .039   .018  -.007   .010  -.009
Sb13  .1789 .5531  .3239  .5 .042   .030   .031   .040   .008  -.013  -.005
S1    .1038    .5 -.0582     .024
S2    .1180    .5  .6966     .019
S3    .0589    .5  .2224     .019
S4    .2382     0  .4323     .021
S5    .2256     0  .1585     .024
S6    .2724     0  .3087     .017
S7    .2049     0  .5524     .026
S8    .0335    .5  .3265     .018
S9    .1005    .5  .3677     .018
S10   .0776    .5  .5113     .018
S11   .3063     0  .1939     .017
S12   .0977     0  .7924     .023
S13   .0890     0  .1453     .028
S14  -.0228    .5  .1476     .022
S15  -.0594     0  .0135     .023
S16   .1413     0  .0881     .047
S17   .1831    .5  .0330     .029
S18   .0582     0  .6156     .030
S19   .2558    .5  .0762     .027
S20   .1296     0  .5017     .025
S21  -.0257     0  .2688     .029
S22   .1710     0  .6763     .024
S23   .1379    .5  .2388     .023
S24   .0153     0  .0876     .030
S25   .0186     0  .4418     .038
S26   .1609     0  .3794     .040
S27   .1504    .5  .8733     .040
S28   .1941     0  .2637  .5 .031
Cl    .1994     0  .2654  .5 .031
O1    .3154    .5  .0925  .5 .022
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Jamesonite
Download hom/jamesonite.pdf
Leone P, Le Leuch L M, Palvadeau P, Molinie P, Moelo Y
 
Solid State Sciences 5 (2003) 771-776
Single crystal structures and magnetic properties of two iron or
manganese-lead-antimony sulfides: MPb4Sb6S14 (M: Fe, Mn)
Locality: Siberia
_database_code_amcsd 0015519
4.0235 19.074 15.737 90 91.89 90 P2_1/c
atom     x      y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb1  .4415 .23983 .57470 .0349  .0354  .0328  .0364  .0005 -.0001  .0005
Pb2  .4638 .14056 .81770 .0376  .0352  .0437  .0340 -.0006 -.0003  .0033
Sb1  .8819 .04877 .60418 .0325  .0420  .0280  .0277 -.0026  .0030  .0012
Sb2  .9109 .93675 .81978 .0315  .0374  .0288  .0288 -.0020  .0072 -.0035
Sb3  .8814 .15908 .36996 .0373  .0480  .0304  .0329 -.0102 -.0092  .0055
Fe      .5      0      0 .0359   .053   .025   .030  -.005   .009  -.004
S1   .4548  .1021  .4970 .0315
S2   .9492  .1591  .6826 .0293
S3   .9767  .0437  .9042 .0259
S4   .9301  .2691  .4479 .0293
S5   .4690  .0038  .7141 .0295
S6   .4230  .2964  .7757 .0342
S7   .5126  .3937  .5812 .0323
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Benavidesite
Download hom/benavidesite.pdf
Leone P, Le Leuch L M, Palvadeau P, Molinie P, Moelo Y
 
Solid State Sciences 5 (2003) 771-776
Single crystal structures and magnetic properties of two iron or
manganese-lead-antimony sulfides: MPb4Sb6S14 (M: Fe, Mn)
Loclaity: synthetic
_database_code_amcsd 0015520
4.0216 19.178 15.837 90 91.89 90 P2_1/c
atom     x      y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb1  .4353 .23947 .57327 .0267  .0221  .0273  .0304 -.0013 -.0012  .0002
Pb2  .4601 .14075 .81386 .0294  .0197  .0421  .0261 -.0017 -.0026  .0054
Sb1  .8816 .04837 .60328 .0239  .0282  .0224  .0211  .0017  .0003  .0027
Sb2  .9096 .93673 .81873 .0240  .0270  .0235  .0217 -.0020  .0048 -.0040
Sb3  .8759 .15916 .36946 .0276  .0362  .0223  .0233  .0072 -.0113 -.0040
Mn      .5      0      0 .0226   .024   .024   .019  -.001  -.003  -.005
S1    .449  .1014  .4964  .022
S2    .943  .1596  .6817  .023
S3    .974  .0453  .9006 .0170
S4    .920  .2695  .4499 .0211
S5    .468  .0031  .7140  .027
S6    .412  .2966  .7750  .026
S7    .512  .3928  .5836 .0222
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Lulzacite
 
Leone P, Palvadeau P, Moelo Y
 
Chimie de l'etat Solide et Cristallochimie 3 (2000) 301-308
Structure cristalline d'un nouvel hydroxyphosphate naturel de strontium,
fer et aluminium (lulzacite), Sr2Fe(Fe0,63Mg0,37)2Al4(PO4)4(OH)10
Locality: Saint-Aubin-des-Chateaux, Loire-Atlantique, France
_database_code_amcsd 0018779
5.457 9.131 9.769 108.47 91.72 97.44 P-1
atom     x     y     z occ Uiso
Sr   .1406 .7738 .4172 .96 .020
Ba   .1406 .7738 .4172 .04 .020
P1   .2292 .6779 .7643 .98 .010
V1   .2292 .6779 .7643 .02 .010
P2   .3018 .0717 .7247 .98 .010
V2   .3018 .0717 .7247 .02 .010
FeM1     0    .5     0     .012
AlM2    .5     0     0     .010
AlM3    .5    .5    .5     .010
FeM4 .2378 .1252 .2747 .63 .005
MgM4 .2378 .1252 .2747 .37 .005
AlM5 .5126 .5750 .1627     .010
O1   .5408 .2015 .1599     .011
O2   .2210 .5354 .8203     .012
O3   .0126 .2586 .2034     .014
O4   .2618 .6233 .5995     .014
O5   .6871 .7607 .2842     .012
O6   .0514 .9848 .6445     .013
O7   .4901 .0068 .3539     .016
O8   .3107 .0830 .8855     .012
O9   .2347 .6750 .1469     .012
O10  .3667 .5216 .3210     .010
O11  .3370 .4004 .0094     .011
O12  .2225 .9450 .0842     .013
O13  .7170 .6820 .5322     .005
H1    .235  .450  .280
H2    .096  .915  .030
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View JMOL 3-D Structure
 
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Total number of retrieved datasets: 9
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