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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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95535 50010055 1 O5N6C38H52 A5B6C38D52 -227.1 7.6 -8.73 -0.4 0
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95536 50010058 1 O5N6C35H48 A5B6C35D48 -211.68 5.18 -9.04 -0.12 0
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95537 50010061 1 F2O5N6C37H42 A2B5C6D37E42 -262.53 11.08 -8.87 -0.5 0
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95538 50010072 1 ClO5N6C34H45 AB5C6D34E45 -219.5 6.79 -8.86 -0.67 0
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95539 50010079 1 ClO4N5C26H32 AB4C5D26E32 -150.32 2.3 -8.98 -0.74 0
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95540 50010098 1 ClO5N6C34H45 AB5C6D34E45 -213.35 10.06 -8.76 -0.82 0
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95541 50010118 1 N6O6C35H46 A6B6C35D46 -236.2 5.34 -8.89 -0.2 0
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95543 50010145 1 FO5N6C38H45 AB5C6D38E45 -217.96 7.5 -8.87 -0.45 0
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95544 50010147 1 F2O5N6C37H42 A2B5C6D37E42 -259.18 4.47 -8.9 -0.52 0
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95545 50010149 1 FO5N6C38H45 AB5C6D38E45 -226.76 6.56 -8.79 -0.4 0
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95546 50010150 1 F2O5N6C37H42 A2B5C6D37E42 -258.73 11.04 -8.8 -0.67 0
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95547 50010164 1 FO5N6C36H41 AB5C6D36E41 -207.29 8.99 -8.54 -0.74 0
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95548 50010166 1 N6O6C37H44 A6B6C37D44 -203.76 10.08 -8.35 -0.49 0
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95549 50010176 1 ClO5N6C30H37 AB5C6D30E37 -198.71 7.68 -8.96 -0.72 0
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95550 50010181 1 ClO5N6C34H45 AB5C6D34E45 -216.42 8.39 -8.9 -0.65 0
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95551 50010207 1 ClO5N6C30H37 AB5C6D30E37 -199.33 10.14 -8.91 -0.84 0
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95552 50010244 1 O5N6C37H44 A5B6C37D44 -172.94 7.59 -8.63 -0.36 0
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95553 50010279 1 O5N6C34H46 A5B6C34D46 -209.63 11.02 -9.02 -0.77 0
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95554 50010320 1 O4N5C31H41 A4B5C31D41 -158.3 4.02 -9.06 -0.27 0
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95555 50010326 1 O4N5C29H39 A4B5C29D39 -160.92 9.27 -9.14 -0.42 0
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95556 50010336 1 F2O4N5C31H33 A2B4C5D31E33 -210.58 10.88 -8.75 -0.62 0
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95557 50010337 1 F2O4N5C31H33 A2B4C5D31E33 -201.02 3.04 -9.09 -0.67 0
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95558 50010339 1 FO4N5C32H36 AB4C5D32E36 -171.72 9.11 -8.93 -0.83 0
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95559 50010340 1 O4N5C31H41 A4B5C31D41 -164.7 7.47 -9.0 -0.34 0
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95560 50010344 1 O4N5C33H45 A4B5C33D45 -172.23 7.97 -8.91 -0.28 0