PM3 PRECISE XYZ C 2.102 1 0.391 1 0.529 1 0 H 2.51 1 1.295 1 0.101 1 0 H 2.72 1 -0.237 1 1.154 1 0 C 0.64 1 -0.003 1 0.247 1 0 H 0.21 1 -0.958 1 0.698 1 0 C -0.24 1 0.892 1 -0.644 1 0 H -1.282 1 0.438 1 -0.734 1 0 H -0.322 1 1.932 1 -0.183 1 0 H 0.224 1 0.977 1 -1.682 1 0
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Y-Mol 13a
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