Molecule # generated by gosh
1.0
 21.23300000  0.00000000  0.00000000
  0.00000000 26.60400000  0.00000000
  0.00000000  0.00000000 12.67600000
 O    Si   C    N    H  
225  112   8    1    19 
Selective dynamics
Direct
     0.05185     0.39121     0.29921  T T T # O
     0.81339     0.57337     0.68777  T T T # O
     0.73422     0.23229     0.85313  T T T # O
     0.02246     0.05156     0.49349  T T T # O
     0.64451     0.66726     0.17130  T T T # O
     0.05185     0.07337     0.29921  T T T # O
     0.60095     0.57471     0.17096  T T T # O
     0.64451     0.66726     0.81569  T T T # O
     0.33416     0.64745     0.88951  T T T # O
     0.33416     0.31713     0.09747  T T T # O
     0.93262     0.92263     0.99349  T T T # O
     0.43262     0.79195     0.99349  T T T # O
     0.73422     0.73229     0.13386  T T T # O
     0.22073     0.66726     0.81569  T T T # O
     0.03108     0.06713     0.09747  T T T # O
     0.64451     0.79732     0.17130  T T T # O
     0.93262     0.90844     0.35007  T T T # O
     0.55185     0.64121     0.68777  T T T # O
     0.05185     0.57337     0.29921  T T T # O
     0.22073     0.66726     0.17130  T T T # O
     0.63103     0.98229     0.85313  T T T # O
     0.22073     0.29732     0.17130  T T T # O
     0.26430     0.07471     0.81603  T T T # O
     0.84279     0.05156     0.49349  T T T # O
     0.70548     0.30301     0.99349  T T T # O
     0.05185     0.57337     0.68777  T T T # O
     0.53108     0.81713     0.88951  T T T # O
     0.13103     0.73229     0.13386  T T T # O
     0.14451     0.54732     0.17130  T T T # O
     0.70548     0.66158     0.99349  T T T # O
     0.13103     0.23229     0.13386  T T T # O
     0.65976     0.05301     0.99349  T T T # O
     0.72073     0.91726     0.81569  T T T # O
     0.35083     0.23229     0.34479  T T T # O
     0.03166     0.98229     0.99349  T T T # O
     0.03108     0.39745     0.09747  T T T # O
     0.51441     0.73229     0.64220  T T T # O
     0.83416     0.06713     0.88951  T T T # O
     0.31339     0.64121     0.68777  T T T # O
     0.43262     0.65844     0.35007  T T T # O
     0.76430     0.13987     0.81603  T T T # O
     0.93262     0.04195     0.99349  T T T # O
     0.60095     0.57471     0.81603  T T T # O
     0.10095     0.82471     0.81603  T T T # O
     0.64451     0.29732     0.17130  T T T # O
     0.43262     0.15844     0.63691  T T T # O
     0.03108     0.89745     0.88951  T T T # O
     0.85083     0.98229     0.64220  T T T # O
     0.31339     0.14121     0.29921  T T T # O
     0.05185     0.07337     0.68777  T T T # O
     0.83416     0.06713     0.09747  T T T # O
     0.34279     0.16302     0.49349  T T T # O
     0.93262     0.05614     0.35007  T T T # O
     0.63103     0.48229     0.13386  T T T # O
     0.76430     0.32471     0.81603  T T T # O
     0.81339     0.39121     0.29921  T T T # O
     0.73422     0.23229     0.13386  T T T # O
     0.14451     0.04732     0.81569  T T T # O
     0.43262     0.29195     0.99349  T T T # O
     0.55185     0.14121     0.29921  T T T # O
     0.76430     0.32471     0.17096  T T T # O
     0.60095     0.07471     0.81603  T T T # O
     0.23422     0.98229     0.85313  T T T # O
     0.70548     0.80301     0.99349  T T T # O
     0.81339     0.89121     0.29921  T T T # O
     0.43262     0.80614     0.35007  T T T # O
     0.53108     0.14745     0.88951  T T T # O
     0.01441     0.48229     0.64220  T T T # O
     0.76430     0.82471     0.81603  T T T # O
     0.64451     0.79732     0.81569  T T T # O
     0.15976     0.16158     0.99349  T T T # O
     0.83416     0.56713     0.09747  T T T # O
     0.26430     0.88987     0.81603  T T T # O
     0.85083     0.48229     0.64220  T T T # O
     0.23422     0.48229     0.85313  T T T # O
     0.93262     0.05614     0.63691  T T T # O
     0.33416     0.64745     0.09747  T T T # O
     0.02246     0.91302     0.49349  T T T # O
     0.33416     0.14745     0.09747  T T T # O
     0.23422     0.48229     0.13386  T T T # O
     0.93262     0.55614     0.63691  T T T # O
     0.43262     0.17263     0.99349  T T T # O
     0.72073     0.04732     0.17130  T T T # O
     0.03108     0.39745     0.88951  T T T # O
     0.72073     0.91726     0.17130  T T T # O
     0.85083     0.98229     0.34479  T T T # O
     0.26430     0.38987     0.17096  T T T # O
     0.05185     0.89121     0.29921  T T T # O
     0.93262     0.54195     0.99349  T T T # O
     0.76430     0.63987     0.81603  T T T # O
     0.35083     0.73229     0.34479  T T T # O
     0.43262     0.30614     0.63691  T T T # O
     0.55185     0.82337     0.68777  T T T # O
     0.20548     0.91158     0.99349  T T T # O
     0.01441     0.98229     0.34479  T T T # O
     0.05185     0.39121     0.68777  T T T # O
     0.43262     0.67263     0.99349  T T T # O
     0.22073     0.16726     0.81569  T T T # O
     0.31339     0.64121     0.29921  T T T # O
     0.26430     0.88987     0.17096  T T T # O
     0.81339     0.89121     0.68777  T T T # O
     0.01441     0.48229     0.34479  T T T # O
     0.60095     0.38987     0.81603  T T T # O
     0.33416     0.14745     0.88951  T T T # O
     0.64451     0.16726     0.81569  T T T # O
     0.02246     0.55156     0.49349  T T T # O
     0.13103     0.73229     0.85313  T T T # O
     0.53108     0.31713     0.88951  T T T # O
     0.22073     0.29732     0.81569  T T T # O
     0.84279     0.41302     0.49349  T T T # O
     0.10095     0.13987     0.81603  T T T # O
     0.03108     0.56713     0.09747  T T T # O
     0.26430     0.38987     0.81603  T T T # O
     0.43262     0.80614     0.63691  T T T # O
     0.01441     0.98229     0.64220  T T T # O
     0.14451     0.41726     0.17130  T T T # O
     0.34279     0.66302     0.49349  T T T # O
     0.53108     0.14745     0.09747  T T T # O
     0.60095     0.38987     0.17096  T T T # O
     0.55185     0.64121     0.29921  T T T # O
     0.34279     0.30156     0.49349  T T T # O
     0.84279     0.55156     0.49349  T T T # O
     0.93262     0.55614     0.35007  T T T # O
     0.51441     0.23229     0.64220  T T T # O
     0.83416     0.89745     0.09747  T T T # O
     0.81339     0.39121     0.68777  T T T # O
     0.51441     0.73229     0.34479  T T T # O
     0.53108     0.31713     0.09747  T T T # O
     0.83416     0.39745     0.88951  T T T # O
     0.52246     0.80156     0.49349  T T T # O
     0.10095     0.32471     0.17096  T T T # O
     0.83416     0.39745     0.09747  T T T # O
     0.02246     0.41302     0.49349  T T T # O
     0.03166     0.48229     0.99349  T T T # O
     0.76430     0.13987     0.17096  T T T # O
     0.31339     0.32337     0.68777  T T T # O
     0.72073     0.54732     0.17130  T T T # O
     0.55185     0.82337     0.29921  T T T # O
     0.03108     0.89745     0.09747  T T T # O
     0.15976     0.80301     0.99349  T T T # O
     0.81339     0.57337     0.29921  T T T # O
     0.10095     0.82471     0.17096  T T T # O
     0.14451     0.91726     0.17130  T T T # O
     0.70548     0.16158     0.99349  T T T # O
     0.33416     0.81713     0.88951  T T T # O
     0.65976     0.41158     0.99349  T T T # O
     0.31339     0.82337     0.68777  T T T # O
     0.60095     0.88987     0.81603  T T T # O
     0.81339     0.07337     0.68777  T T T # O
     0.83358     0.98229     0.99349  T T T # O
     0.93262     0.42263     0.99349  T T T # O
     0.23422     0.98229     0.13386  T T T # O
     0.26430     0.57471     0.17096  T T T # O
     0.31339     0.32337     0.29921  T T T # O
     0.55185     0.32337     0.68777  T T T # O
     0.85083     0.48229     0.34479  T T T # O
     0.31339     0.82337     0.29921  T T T # O
     0.72073     0.54732     0.81569  T T T # O
     0.83358     0.48229     0.99349  T T T # O
     0.22073     0.79732     0.17130  T T T # O
     0.34279     0.80156     0.49349  T T T # O
     0.76430     0.82471     0.17096  T T T # O
     0.20548     0.05301     0.99349  T T T # O
     0.76430     0.63987     0.17096  T T T # O
     0.72073     0.04732     0.81569  T T T # O
     0.43262     0.15844     0.35007  T T T # O
     0.60095     0.07471     0.17096  T T T # O
     0.03108     0.56713     0.88951  T T T # O
     0.22073     0.79732     0.81569  T T T # O
     0.64451     0.16726     0.17130  T T T # O
     0.20548     0.41158     0.99349  T T T # O
     0.60095     0.88987     0.17096  T T T # O
     0.83416     0.89745     0.88951  T T T # O
     0.14451     0.91726     0.81569  T T T # O
     0.14451     0.54732     0.81569  T T T # O
     0.93262     0.40844     0.63691  T T T # O
     0.64451     0.29732     0.81569  T T T # O
     0.43262     0.30614     0.35007  T T T # O
     0.15976     0.30301     0.99349  T T T # O
     0.33358     0.23229     0.99349  T T T # O
     0.13103     0.23229     0.85313  T T T # O
     0.33358     0.73229     0.99349  T T T # O
     0.72073     0.41726     0.81569  T T T # O
     0.72073     0.41726     0.17130  T T T # O
     0.52246     0.66302     0.49349  T T T # O
     0.14451     0.04732     0.17130  T T T # O
     0.43262     0.65844     0.63691  T T T # O
     0.53108     0.64745     0.88951  T T T # O
     0.63103     0.48229     0.85313  T T T # O
     0.53108     0.64745     0.09747  T T T # O
     0.35083     0.23229     0.64220  T T T # O
     0.53108     0.81713     0.09747  T T T # O
     0.10095     0.32471     0.81603  T T T # O
     0.65976     0.55301     0.99349  T T T # O
     0.93262     0.40844     0.35007  T T T # O
     0.31339     0.14121     0.68777  T T T # O
     0.63103     0.98229     0.13386  T T T # O
     0.10095     0.13987     0.17096  T T T # O
     0.26430     0.57471     0.81603  T T T # O
     0.65976     0.91158     0.99349  T T T # O
     0.20548     0.55301     0.99349  T T T # O
     0.03108     0.06713     0.88951  T T T # O
     0.22073     0.16726     0.17130  T T T # O
     0.55185     0.14121     0.68777  T T T # O
     0.53166     0.23229     0.99349  T T T # O
     0.81339     0.07337     0.29921  T T T # O
     0.52246     0.16302     0.49349  T T T # O
     0.84279     0.91302     0.49349  T T T # O
     0.33416     0.31713     0.88951  T T T # O
     0.26430     0.07471     0.17096  T T T # O
     0.33416     0.81713     0.09747  T T T # O
     0.15976     0.66158     0.99349  T T T # O
     0.73422     0.73229     0.85313  T T T # O
     0.51441     0.23229     0.34479  T T T # O
     0.10095     0.63987     0.81603  T T T # O
     0.35083     0.73229     0.64220  T T T # O
     0.93262     0.90844     0.63691  T T T # O
     0.53166     0.73229     0.99349  T T T # O
     0.52246     0.30156     0.49349  T T T # O
     0.14451     0.41726     0.81569  T T T # O
     0.05185     0.89121     0.68777  T T T # O
     0.83416     0.56713     0.88951  T T T # O
     0.55185     0.32337     0.29921  T T T # O
     0.10095     0.63987     0.17096  T T T # O
     0.68573     0.60182     0.33507  T T T # O
     0.71209     0.67525     0.11691  T T T # Si
     0.15316     0.28933     0.11691  T T T # Si
     0.71209     0.67525     0.87008  T T T # Si
     0.36018     0.29084     0.61519  T T T # Si
     0.50507     0.17374     0.61519  T T T # Si
     0.08243     0.88322     0.18425  T T T # Si
     0.85816     0.92502     0.99349  T T T # Si
     0.00507     0.92374     0.37179  T T T # Si
     0.21209     0.03933     0.11691  T T T # Si
     0.08243     0.38322     0.18425  T T T # Si
     0.35816     0.28956     0.99349  T T T # Si
     0.65316     0.92525     0.11691  T T T # Si
     0.21209     0.53933     0.87008  T T T # Si
     0.00709     0.03956     0.99349  T T T # Si
     0.71209     0.78933     0.11691  T T T # Si
     0.08243     0.88322     0.80274  T T T # Si
     0.28281     0.63322     0.18425  T T T # Si
     0.15316     0.78933     0.87008  T T T # Si
     0.78281     0.88322     0.80274  T T T # Si
     0.58243     0.33136     0.80274  T T T # Si
     0.50507     0.79084     0.61519  T T T # Si
     0.86018     0.42374     0.37179  T T T # Si
     0.00507     0.54084     0.37179  T T T # Si
     0.50709     0.67502     0.99349  T T T # Si
     0.78281     0.58136     0.80274  T T T # Si
     0.35816     0.17502     0.99349  T T T # Si
     0.86018     0.92374     0.37179  T T T # Si
     0.21209     0.42525     0.11691  T T T # Si
     0.15316     0.17525     0.11691  T T T # Si
     0.78281     0.08136     0.80274  T T T # Si
     0.00507     0.54084     0.61519  T T T # Si
     0.65316     0.53933     0.87008  T T T # Si
     0.85816     0.42502     0.99349  T T T # Si
     0.86018     0.04084     0.61519  T T T # Si
     0.50507     0.67374     0.37179  T T T # Si
     0.08243     0.38322     0.80274  T T T # Si
     0.50507     0.29084     0.37179  T T T # Si
     0.00507     0.42374     0.61519  T T T # Si
     0.58243     0.83136     0.80274  T T T # Si
     0.00507     0.42374     0.37179  T T T # Si
     0.85816     0.53956     0.99349  T T T # Si
     0.86018     0.54084     0.37179  T T T # Si
     0.36018     0.17374     0.37179  T T T # Si
     0.36018     0.79084     0.61519  T T T # Si
     0.36018     0.79084     0.37179  T T T # Si
     0.08243     0.58136     0.18425  T T T # Si
     0.36018     0.29084     0.37179  T T T # Si
     0.21209     0.42525     0.87008  T T T # Si
     0.21209     0.53933     0.11691  T T T # Si
     0.71209     0.17525     0.11691  T T T # Si
     0.85816     0.03956     0.99349  T T T # Si
     0.58243     0.13322     0.80274  T T T # Si
     0.86018     0.54084     0.61519  T T T # Si
     0.00507     0.92374     0.61519  T T T # Si
     0.50507     0.67374     0.61519  T T T # Si
     0.50507     0.29084     0.61519  T T T # Si
     0.58243     0.13322     0.18425  T T T # Si
     0.15316     0.67525     0.11691  T T T # Si
     0.65316     0.92525     0.87008  T T T # Si
     0.71209     0.28933     0.87008  T T T # Si
     0.15316     0.78933     0.11691  T T T # Si
     0.35816     0.78956     0.99349  T T T # Si
     0.86018     0.42374     0.61519  T T T # Si
     0.78281     0.38322     0.18425  T T T # Si
     0.36018     0.67374     0.61519  T T T # Si
     0.00709     0.92502     0.99349  T T T # Si
     0.50709     0.78956     0.99349  T T T # Si
     0.78281     0.08136     0.18425  T T T # Si
     0.50709     0.17502     0.99349  T T T # Si
     0.86018     0.92374     0.61519  T T T # Si
     0.15316     0.67525     0.87008  T T T # Si
     0.21209     0.92525     0.87008  T T T # Si
     0.50507     0.79084     0.37179  T T T # Si
     0.28281     0.13322     0.18425  T T T # Si
     0.28281     0.63322     0.80274  T T T # Si
     0.00507     0.04084     0.37179  T T T # Si
     0.21209     0.92525     0.11691  T T T # Si
     0.28281     0.13322     0.80274  T T T # Si
     0.00709     0.53956     0.99349  T T T # Si
     0.58243     0.63322     0.18425  T T T # Si
     0.15316     0.28933     0.87008  T T T # Si
     0.65316     0.42525     0.11691  T T T # Si
     0.35816     0.67502     0.99349  T T T # Si
     0.28281     0.83136     0.80274  T T T # Si
     0.08243     0.58136     0.80274  T T T # Si
     0.36018     0.67374     0.37179  T T T # Si
     0.15316     0.17525     0.87008  T T T # Si
     0.21209     0.03933     0.87008  T T T # Si
     0.65316     0.42525     0.87008  T T T # Si
     0.58243     0.83136     0.18425  T T T # Si
     0.65316     0.03933     0.87008  T T T # Si
     0.08243     0.08136     0.18425  T T T # Si
     0.50709     0.28956     0.99349  T T T # Si
     0.08243     0.08136     0.80274  T T T # Si
     0.00709     0.42502     0.99349  T T T # Si
     0.50507     0.17374     0.37179  T T T # Si
     0.65316     0.03933     0.11691  T T T # Si
     0.28281     0.33136     0.80274  T T T # Si
     0.00507     0.04084     0.61519  T T T # Si
     0.28281     0.33136     0.18425  T T T # Si
     0.71209     0.78933     0.87008  T T T # Si
     0.78281     0.88322     0.18425  T T T # Si
     0.58243     0.63322     0.80274  T T T # Si
     0.78281     0.58136     0.18425  T T T # Si
     0.65316     0.53933     0.11691  T T T # Si
     0.71209     0.28933     0.11691  T T T # Si
     0.71209     0.17525     0.87008  T T T # Si
     0.78281     0.38322     0.80274  T T T # Si
     0.58243     0.33136     0.18425  T T T # Si
     0.28281     0.83136     0.18425  T T T # Si
     0.36018     0.17374     0.61519  T T T # Si
     0.86018     0.04084     0.37179  T T T # Si
     0.48102     0.48974     0.54199  T T T # C
     0.54216     0.50524     0.36807  T T T # C
     0.59647     0.50055     0.60110  T T T # C
     0.54112     0.46468     0.58441  T T T # C
     0.47820     0.49623     0.42138  T T T # C
     0.67235     0.56403     0.53839  T T T # C
     0.67144     0.48231     0.45618  T T T # C
     0.58488     0.54315     0.42295  T T T # C
     0.62977     0.52128     0.50514  T T T # N
     0.47577     0.52686     0.58139  T T T # H
     0.64410     0.44871     0.43370  T T T # H
     0.70686     0.54955     0.59611  T T T # H
     0.69264     0.58015     0.46064  T T T # H
     0.45610     0.46262     0.38512  T T T # H
     0.56677     0.46889     0.35593  T T T # H
     0.53432     0.51936     0.28687  T T T # H
     0.55693     0.57169     0.46619  T T T # H
     0.61777     0.56521     0.36928  T T T # H
     0.69415     0.49913     0.38602  T T T # H
     0.70761     0.47130     0.51459  T T T # H
     0.64255     0.59316     0.57568  T T T # H
     0.43954     0.46764     0.56777  T T T # H
     0.63365     0.48260     0.64952  T T T # H
     0.55460     0.43137     0.53657  T T T # H
     0.53142     0.44955     0.66445  T T T # H
     0.44629     0.52811     0.40288  T T T # H
     0.57978     0.53389     0.64541  T T T # H
     0.68669     0.63695     0.35715  T T T # H