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Frame 0, Iteration: 100
C -1.260117 -0.035518 0.073136
H -2.008011 0.133027 -0.725655
H -1.776386 -0.284095 0.997374
C -0.303774 1.146861 0.310580
H -0.371540 1.934299 -0.440269
H -0.396737 1.589900 1.308928
C 1.147225 0.585077 0.069935
H 1.792386 0.636507 0.949436
H 1.633443 1.150220 -0.729269
C -0.427645 -1.328746 -0.225201
H -0.720888 -1.726127 -1.194202
H -0.607398 -2.141395 0.488493
C 1.074616 -0.900803 -0.300684
H 1.615137 -1.451337 0.477569
H 1.544287 -1.018958 -1.282630
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