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paduagroup / clandp Public

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Fork 33
Star 53

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clandp

/

c1SO4.zmat

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13 lines (11 loc) · 311 Bytes

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clandp

/

c1SO4.zmat

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13 lines (11 loc) · 311 Bytes

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methylsulfate

1 HS4

2 CS4 1 1.090

3 OC4 2 1.529 1 109.5

4 HS4 2 1.090 1 109.5 3 120.0

5 HS4 2 1.090 1 109.5 3 240.0

6 SO 3 1.810 2 109.5 1 180.0

7 OS4 6 1.810 3 109.5 2 180.0

8 OS4 6 1.810 3 109.5 2 60.0

9 OS4 6 1.810 3 109.5 2 300.0

il.ff

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