No title 1.0 10.00000000 0.00000000 0.00000000 0.00000000 10.00000000 0.00000000 0.00000000 0.00000000 10.00000000 Si N Cl H 1 1 3 3 Direct 0.40475172 0.67910193 0.47251897 # 1 Si 0.48798220 0.53271787 0.49068213 # 2 N 0.23332019 0.65801184 0.57790508 # 3 Cl1 0.50353299 0.84757515 0.53742185 # 4 Cl2 0.36867131 0.70637454 0.27298077 # 5 Cl3 0.59185650 0.53290103 0.47363524 # 6 H1 0.43193744 0.28393412 0.46635376 # 7 H2 0.44198416 0.36192741 0.53421250 # 8 H3