          24
 QM XYZ file for CP2K
     O          6.307012394          4.702876738          0.207717302
     H          5.895966370          5.513852867         -0.253497696
     H          7.245940768          4.918017745          0.358624083
     O          6.056822675          4.820631298          2.910911317
     H          6.878977363          5.313539183          3.200986144
     H          5.997227412          4.666566646          1.952726614
     O          1.522797180          1.827598015          1.224620142
     H          0.585602158          1.697205680          1.316345601
     H          1.829049885          2.181662858          2.084091936
     O          3.297279301          4.094172028          0.965336216
     H          3.562228788          4.711386914          1.635487941
     H          3.508214669          4.440634544          0.041300763
     O          5.256178043          6.917156974          6.307997665
     H          4.287393063          6.876614930          6.312225061
     H          5.485719376          7.644191702          6.798624834
     O          0.929519297          5.266510263          1.297561503
     H          1.382161018          4.645635429          0.719870256
     H          1.369756096          6.181376489          1.131792059
     O          3.937526987          4.666867049          6.042030980
     H          3.216797632          4.906143914          5.417539955
     H          4.483019069          4.050909745          5.586000583
     O          0.314971309          1.806282397          3.835561035
     H          0.921444460          2.433128162          4.223392809
     H         -0.574807543          2.183143227          4.120082438
