No title 1 20.000000 0.000000 0.000000 0.000000 15.000000 0.000000 0.000000 0.000000 15.000000 N H C Si O 1 22 7 2 4 Direct configuration= 1 0.66287336 0.47510588 0.59702473 0.68303631 0.46260393 0.65547530 0.69591595 0.45389004 0.54920088 0.15330460 0.51640708 0.36783204 0.21046490 0.60848330 0.36669561 0.22279373 0.51652208 0.29298674 0.11282590 0.54679850 0.65756743 0.15193566 0.63551060 0.59768255 0.10881860 0.54888006 0.53864939 0.42173337 0.42803340 0.29461205 0.42148877 0.33821380 0.37290809 0.34839796 0.40682851 0.35990189 0.53138911 0.27009987 0.57401511 0.53498949 0.35283230 0.47836333 0.62278169 0.42938977 0.59054959 0.24942052 0.68836417 0.50441179 0.30745084 0.66535586 0.59069650 0.33184637 0.65414620 0.47706839 0.44327561 0.61765718 0.55852820 0.45301136 0.55502826 0.65852961 0.51585155 0.55086642 0.57466884 0.32703442 0.44407888 0.64127477 0.31236990 0.37651903 0.54719570 0.32893996 0.44364784 0.56774493 0.20631765 0.53536380 0.36040000 0.14093512 0.56336796 0.59674031 0.40349961 0.40659308 0.36035781 0.51637585 0.33197639 0.54381040 0.29050002 0.64375745 0.52432437 0.46156304 0.55431259 0.58606172 0.41828939 0.45756416 0.53415860 0.26461312 0.52351569 0.52650276 0.24680693 0.48957926 0.42360262 0.20025566 0.51106512 0.59557262 0.42898767 0.46773764 0.42521444 0.45416205 0.36223077 0.56958051