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 0.71761427 0.44151732 0.59268179 0.73973624 0.45277908 0.65391877 0.75815506 0.44238594 0.54926269 0.14969373 0.51756624 0.36671448 0.20515765 0.61131714 0.36880764 0.21977505 0.52181059 0.29304529 0.10912966 0.55000333 0.65733385 0.14903962 0.63862458 0.59846104 0.10513218 0.55336693 0.53845875 0.41849283 0.43171977 0.29456832 0.41733310 0.34153315 0.37261618 0.34450351 0.41043844 0.35869228 0.53088048 0.27652712 0.57282408 0.53163726 0.34893587 0.47936327 0.55580154 0.39056066 0.58570360 0.24587485 0.69053124 0.50462628 0.30317684 0.66727781 0.59156841 0.32847725 0.65645709 0.47827282 0.43982394 0.62089270 0.55894691 0.44886004 0.55732082 0.65865968 0.51166477 0.55296822 0.57495496 0.32326160 0.44610654 0.64157189 0.30844646 0.37825508 0.54760054 0.32542844 0.44548544 0.56781424 0.20241491 0.53829580 0.36063923 0.13739476 0.56669185 0.59672080 0.39982771 0.41036263 0.36026977 0.52177177 0.34523780 0.55148224 0.28674570 0.64587823 0.52488465 0.45723454 0.55673234 0.58600225 0.41547796 0.45766949 0.53488864 0.26088620 0.52570168 0.52638764 0.24311745 0.49212149 0.42309773 0.19605180 0.51326860 0.59511299 0.42442586 0.47104860 0.42557361 0.45181097 0.36493729 0.56838232