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 0.74073073 0.42844195 0.59155508 0.76211712 0.44510426 0.65271363 0.78149314 0.43251683 0.54850508 0.14792298 0.51819972 0.36598497 0.20268960 0.61277269 0.36963945 0.21844233 0.52419798 0.29306800 0.10715228 0.55159904 0.65720824 0.14756790 0.64012095 0.59875467 0.10330379 0.55553286 0.53837854 0.41692683 0.43339229 0.29447403 0.41529557 0.34304888 0.37243287 0.34264061 0.41206377 0.35802600 0.52737905 0.27578251 0.57369918 0.53012791 0.34921217 0.47939375 0.55155575 0.38929178 0.58804213 0.24416904 0.69184708 0.50470377 0.30118375 0.66836774 0.59201106 0.32683481 0.65749241 0.47885057 0.43793126 0.62053199 0.55874331 0.44710552 0.55774159 0.65890974 0.51003167 0.55334378 0.57505944 0.32128014 0.44728038 0.64153891 0.30633022 0.37935608 0.54779752 0.32300742 0.44655671 0.56794486 0.20060068 0.53968367 0.36081406 0.13571894 0.56819721 0.59671704 0.39787624 0.41176894 0.35978025 0.51767915 0.34452449 0.55097190 0.28489912 0.64693197 0.52521364 0.45567349 0.55686332 0.58635577 0.41303384 0.45849282 0.53470197 0.25897498 0.52674639 0.52653784 0.24113089 0.49342651 0.42338705 0.19413411 0.51442591 0.59484072 0.42223716 0.47271215 0.42531342 0.44907800 0.36475810 0.56784119