Triclinic periodic calculation 64 atoms 0.0 10.7422053 xlo xhi 0.0 10.7422053 ylo yhi 0.0 10.7422053 zlo zhi 0.0 0.0 0.0 xy xz yz 1 atom types Atoms 1 1 1.05372412522 2.2264813000000006 1.9227813 2 1 3.23281033513 2.6862842999999996 1.1071213 3 1 3.81671587569 0.7745107 2.4256333 4 1 0.734769473901 4.4957563 1.9475963 5 1 3.12554810577 4.7334603 2.3816703000000006 6 1 2.0284566679 1.4833073000000003 3.8975983 7 1 -0.0865568303421 4.741505300000001 4.1574643 8 1 1.60928019318 3.4355832999999993 5.1454103 9 1 4.670309928600001 2.9879433 3.0060483 10 1 0.5826038496720002 2.4059043 7.024752299999999 11 1 2.56053550785 1.1057293 7.0874502999999995 12 1 3.77507114565 4.0717053000000005 5.873310300000001 13 1 1.51080084521 1.7573543 9.138058300000003 14 1 3.85303717643 1.4312863 8.9972583 15 1 5.52386386929 3.1316723 8.838925300000003 16 1 2.85727812004 4.8740013 7.918439300000001 17 1 1.75245899921 8.118908300000001 1.1975373 18 1 4.75846255595 5.465787299999999 0.7366181 19 1 2.3672825252399994 10.3167353 0.7856697 20 1 0.8212900772380001 6.8916002999999995 3.9888532999999997 21 1 2.9323264837 7.0885353 2.9136033 22 1 0.326894557551 10.6755153 4.0477333 23 1 3.94686769494 8.3180393 4.7484843 24 1 5.28233836588 10.097895300000001 3.7330923 25 1 3.23764272862 6.3442543 6.003667299999999 26 1 2.18047525078 9.548176300000002 7.5775553 27 1 1.89119185069 9.3468443 5.2433833 28 1 5.2087862841499994 8.7048313 6.7802003 29 1 1.8703171542600001 7.1097963 7.806662300000001 30 1 4.80115497033 5.3730333 9.1137043 31 1 0.255242386438 7.8545743 9.433905300000001 32 1 0.9114193772760001 10.2051953 9.578999300000001 33 1 3.89157658572 8.1429003 8.622869300000001 34 1 4.13140736875 10.0620753 10.0277253 35 1 9.65807513 1.3119013 2.5023123 36 1 6.2176029237799995 3.7546993 1.4564413000000003 37 1 7.832427458700001 5.2045773 2.3898813000000003 38 1 9.4379476299 4.518671300000001 0.747456 39 1 7.271542604420001 0.48625599999999997 4.4426823 40 1 8.86148241229 2.1730273 4.614015299999999 41 1 5.40602563012 0.9555283000000001 5.701751300000001 42 1 10.0421794765 0.6853822 6.0054362999999995 43 1 5.88932089602 3.1276623 6.5125373 44 1 7.90157019788 4.1053803 5.659421300000001 45 1 9.861125568490001 5.1914453 6.4533163 46 1 6.23391892928 -0.19088260000000004 10.9234753 47 1 6.78132631775 2.1166783000000002 10.6018953 48 1 9.093697576890001 2.1607863 10.9959653 49 1 9.385327634200001 -0.09771388 10.2733353 50 1 6.48479483084 6.926698300000001 1.4624533 51 1 9.551158501440002 6.8263492999999995 0.24407980000000004 52 1 6.800349628270001 9.226616300000003 2.0267743 53 1 10.371214035300001 7.8993393 2.1851513 54 1 9.080094120330001 9.851128300000001 1.7171663000000001 55 1 8.079570861150001 7.8322203 4.791056300000001 56 1 6.776237922949999 5.779993299999999 4.464567299999999 57 1 6.75309396417 6.9512363 6.5378733 58 1 8.34433202708 6.2029353 8.0777583 59 1 10.1519566936 7.418803300000001 5.7923703 60 1 6.39364689401 10.5716853 7.5333502999999995 61 1 8.16853502764 9.8623723 6.1602463 62 1 9.299880291950002 8.3938723 7.828832299999999 63 1 7.41174997298 7.138807300000001 10.063385300000002 64 1 7.5846182882 9.4067103 9.304364300000001 Masses 1 28.0855