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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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194570 78558093 1 N4O5C19H22 A4B5C19D22 -93.4 9.84 -9.13 -0.59 0
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194571 78558094 1 N3O5C18H21 A3B5C18D21 -98.99 5.64 -9.31 -0.87 0
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194572 78558095 1 N3O5C17H19 A3B5C17D19 -89.19 10.64 -10.06 -0.95 0
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194573 78558096 1 N4O6C17H20 A4B6C17D20 -127.78 4.85 -8.74 -1.0 0
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194574 78558097 1 N4O5C16H18 A4B5C16D18 -89.08 3.81 -9.16 -1.04 0
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194575 78558098 1 N4O6C15H18 A4B6C15D18 -121.6 6.27 -9.82 -0.72 0
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194576 78558361 1 N3O5C18H21 A3B5C18D21 -193.31 4.69 -8.45 -0.12 0
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194577 78558362 2 NO2C12H12 AB2C12D12 -121.0 7.24 -8.34 -0.66 0
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194578 78558471 1 NO4C21H21 AB4C21D21 -125.86 2.71 -8.79 -0.47 0
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194579 78558511 1 Cl2O3N4H12C16 A2B3C4D12E16 -23.6 1.92 -9.76 -1.83 0
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194580 78558512 1 O3N4C24H30 A3B4C24D30 -83.54 8.17 -9.25 -0.88 0
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194581 78558657 1 NCl2O4C19H19 AB2C4D19E19 -152.9 5.38 -8.97 -0.76 0
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194582 78558658 1 NCl2O4H19C20 AB2C4D19E20 -134.12 4.33 -8.88 -0.67 0
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194583 78558722 1 FNCl3O3H11C16 ABC3D3E11F16 -151.66 2.75 -9.33 -1.53 0
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194584 78558723 1 NCl2O3H17C22 AB2C3D17E22 -69.59 2.46 -8.94 -1.44 1
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194585 78558778 1 Cl2N2O3C15H21 A2B2C3D15E21 -100.54 5.52 0.0 0.0 0
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194586 78559073 1 SN3O3C23H31 AB3C3D23E31 -121.08 3.75 -8.44 -0.52 0
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194587 78559223 1 SO3N5C19H21 AB3C5D19E21 -10.35 2.93 -8.3 -1.7 0
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194588 78559224 1 OSN4C14H24 ABC4D14E24 -35.24 6.43 -8.99 -0.4 0
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194589 78559225 2 NOSC9H12 ABCD9E12 -71.67 2.88 -8.42 -0.92 0
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194590 78559226 1 OSN4C18H24 ABC4D18E24 2.95 5.53 -8.9 -0.35 0
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194591 78559227 1 OS2N4C15H20 AB2C4D15E20 9.62 6.03 -8.9 -0.36 0
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194592 78559228 1 OSF2N4C17H20 ABC2D4E17F20 -87.91 6.14 -8.89 -0.39 0
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194593 78559229 2 OSN2C10H13 ABC2D10E13 -50.68 4.6 -8.73 -1.22 0
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194594 78559230 1 OS2N5C19H23 AB2C5D19E23 27.04 3.03 -9.0 -0.75 0