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1277.380,7.8486003E-02 1277.862,0.1018850 1278.345,0.1210790 1278.827,0.1502730 1279.309,0.1800450 1279.791,0.1977520 1280.273,0.2111330 1280.755,0.2415730 1281.237,0.2835580 1281.719,0.2413710 1282.202,0.1043590 1282.684,7.2123997E-02 1283.166,0.1147670 1283.648,1.062646 1284.130,3.110563 1284.612,4.300989 1285.094,3.226339 1285.576,1.380079 1286.058,0.4445570 1286.541,9.7891003E-02 1287.023,0.0000000E+00 ##MOLFORM=C13 Ba6 Ca6 Mg O39 ##RESOLUTION=4 ##PRESSURE=100 ##TEMPERATURE=26.85 ##END=