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17 lines
904 B
17 lines
904 B
CHARGE 0.00 ( 0 ) |
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Formula: H4 C1 N2 O1 |
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ATOM 1 C URA 1 1.022 0.070 0.068 0.353000 14 |
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ATOM 2 O URA 1 0.417 0.965 -0.476 -0.400000 31 |
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ATOM 3 N URA 1 0.398 -0.967 0.698 -0.402000 22 |
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ATOM 4 N1 URA 1 2.385 0.013 0.102 -0.402000 22 |
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ATOM 5 H URA 1 -0.605 -0.976 0.703 0.212500 91 |
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ATOM 6 H1 URA 1 0.893 -1.712 1.150 0.212500 91 |
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ATOM 7 H2 URA 1 2.896 0.751 -0.346 0.212500 91 |
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ATOM 8 H3 URA 1 2.892 -0.726 0.551 0.212500 91 |
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BOND 1 1 2 0 C O |
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BOND 2 1 3 0 C N |
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BOND 3 1 4 0 C N1 |
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BOND 4 3 5 0 N H |
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BOND 5 3 6 0 N H1 |
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BOND 6 4 7 0 N1 H2 |
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BOND 7 4 8 0 N1 H3
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