I am new to the solid state ab-initio calculations. I need to optimize the unit cell of paracetamol. For this, I required Fractional coordinates for the system. When I extract fractional coordinates from cif (attached), my calculation program always told me that my unit cell is not neutral. However, paracetamol is a neutral system so its unit cell should not be charged.

My question is how to extract Fractional coordinates in such a way that I could get a neutral unit cell of paracetamol?

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