%chk=000110752.chk %nprocshared=12 %mem=21GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000110752 0 1 Si -1.616300 0.2339000 1.1700000E-02 O -2.747700 0.5773000 1.204100 O -1.837700 -1.341900 -0.5215000 O -1.863700 1.281400 -1.276800 N 1.400000 -2.304900 5.1199999E-02 N 5.074400 0.5631000 0.4919000 C 1.309600 0.1932000 -0.2406000 C 0.1104000 0.4623000 0.7062000 C 2.626000 0.4545000 0.5362000 C 1.256600 -1.206400 -0.8984000 C 3.886900 0.3077000 -0.3176000 C -2.749700 -0.1812000 2.405400 C -3.085100 -1.721500 -1.084800 C -1.763700 2.682500 -1.067000 H 1.261100 0.9268000 -1.058100 H 0.1829000 1.491800 1.078600 H 0.2036000 -0.1807000 1.589800 H 2.684200 -0.2230000 1.398300 H 2.592700 1.472800 0.9469000 H 0.3584000 -1.343700 -1.503500 H 2.074200 -1.286900 -1.623400 H 3.862700 1.008500 -1.158400 H 3.976500 -0.7018000 -0.7273000 H 1.363900 -3.191200 -0.4507000 H 0.6082000 -2.310800 0.6924000 H 5.018800 1.497700 0.8953000 H 5.095700 -8.1299998E-02 1.281600 H -1.839500 1.9999999E-04 2.986800 H -3.603600 0.1422000 3.008500 H -2.864800 -1.252000 2.204300 H -3.899100 -1.606900 -0.3606000 H -3.300800 -1.145600 -1.991400 H -3.024900 -2.778400 -1.361800 H -0.7449000 2.968100 -0.7841000 H -2.004100 3.184300 -2.009300 H -2.478300 3.024700 -0.3103000 %chk=000110752-Freq.chk %nprocshared=4 %mem=3GB #p freq=noraman PBEPBE/SDD 000110752 0 1 Si -1.364604 0.352864 0.278928 O -2.598239 0.936153 1.344886 O -1.781489 -1.268639 -0.185373 O -1.421938 1.451264 -1.031407 N 1.117456 -2.188742 -0.516507 N 5.442320 0.320211 0.575687 C 1.545160 0.249784 -0.038018 C 0.377448 0.252530 0.992850 C 2.893571 0.084289 0.711628 C 1.347835 -0.857932 -1.116918 C 4.145195 0.467188 -0.124468 C -3.043913 0.293690 2.576226 C -2.969071 -1.634124 -0.955374 C -2.556066 2.260525 -1.469701 H 1.540870 1.224079 -0.572377 H 0.503208 1.104423 1.689741 H 0.439362 -0.675726 1.594680 H 2.971374 -0.972691 1.040116 H 2.889455 0.711321 1.628683 H 0.513842 -0.543074 -1.785930 H 2.254853 -0.900770 -1.748124 H 4.057319 1.519779 -0.459214 H 4.193664 -0.147602 -1.043291 H 1.537691 -2.966381 -1.030709 H 0.125535 -2.346985 -0.297459 H 5.528582 0.931907 1.395867 H 5.656078 -0.652398 0.825416 H -2.279508 0.383157 3.373604 H -3.959433 0.815341 2.901246 H -3.272369 -0.779425 2.419055 H -3.878602 -1.139618 -0.559498 H -2.842289 -1.360167 -2.020542 H -3.089542 -2.727151 -0.874565 H -2.144767 3.171253 -1.936500 H -3.153022 1.709262 -2.222122 H -3.203066 2.537206 -0.616916