ATOM        9 
            1   C8y C    22.1200  -15.7863 
            2   C8x C    20.9103  -16.4776 
            3   C8x C    23.3362  -16.4776 
            4   C2c C    22.1137  -14.3909 
            5   C8x C    20.9103  -17.8859 
            6   C8x C    23.3362  -17.8859 
            7   N1a N    20.9038  -13.6997 
            8   N2a N    23.3169  -13.6932 
            9   C8x C    22.1200  -18.5963 
BOND        9 
            1     1   2 2 
            2     1   3 1 
            3     1   4 1 
            4     2   5 1 
            5     3   6 2 
            6     4   7 1 
            7     4   8 2 
            8     5   9 2 
            9     6   9 1 
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