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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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84500 49866983 1 ClN5O7C26H38 AB5C7D26E38 -320.74 10.78 -9.53 -0.7 0
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84501 49867005 1 SP2N7O15C23H37 AB2C7D15E23F37 -718.21 6.64 -9.09 -0.75 0
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84502 49867033 1 N2O4C5H10 A2B4C5D10 -186.13 3.58 -10.77 0.1 0
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84503 49867038 1 N3O3C14H17 A3B3C14D17 -94.83 4.43 -8.69 -0.2 0
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84504 49867040 1 N3O4C18H31 A3B4C18D31 -224.0 2.7 -9.73 0.44 0
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84505 49867042 2 O4C33H63 A4B33C63 -590.34 3.53 -9.34 0.64 0
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84506 49867043 1 PSeN5O6C10H13 ABC5D6E10F13 -163.59 10.42 0.0 0.0 0
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84507 49867045 1 PN5O7C10H14 AB5C7D10E14 -313.42 2.36 -9.46 -0.66 0
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84508 49867074 1 ON5H13C14 AB5C13D14 73.34 1.68 -9.38 -1.19 0
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84509 49867088 1 N2P2O8C13H20 A2B2C8D13E20 -443.78 3.39 -8.83 -1.31 0
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84510 49867101 1 FeN4O5H32C33 AB4C5D32E33 -66.93 5.95 -7.41 -1.56 0
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84511 49867103 3 ON2C3H4 AB2C3D4 -64.79 13.47 -9.09 -0.35 0
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84512 49867104 1 SnN2C8O8H23 AB2C8D8E23 -366.89 7.65 0.0 0.0 0
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84513 49867105 1 SnN2O5C8H17 AB2C5D8E17 -188.57 3.55 0.0 0.0 0
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84514 49867144 1 SC6H10O10 AB6C10D10 -421.26 3.94 -11.22 -1.24 0
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84515 49867163 1 F2S2N4O5H22C27 A2B2C4D5E22F27 -84.9 7.98 -9.84 -2.47 2
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84516 49867180 1 N5H15C16 A5B15C16 137.93 1.36 -6.99 -0.63 0
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84517 49867224 1 N2S2O3C14H28 A2B2C3D14E28 -179.61 6.82 -9.2 0.15 0
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84518 49867228 1 NO7C25H33 AB7C25D33 -276.51 3.61 -9.62 -0.52 0
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84519 49867238 1 O3N4C8H12 A3B4C8D12 -110.35 2.21 -9.48 -0.3 0
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84520 49867253 1 N2O5C11H12 A2B5C11D12 -144.78 5.41 -9.58 -0.93 0
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84521 49867254 1 NO3C13H27 AB3C13D27 -188.93 2.99 -9.45 0.54 4
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84522 49867255 1 PtN2C6H16 AB2C6D16 42.09 4.52 -8.79 -1.05 0
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84523 49867256 1 SN2O9C16H26 AB2C9D16E26 -404.64 6.57 -10.45 -0.81 0
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84524 49867259 1 N2O13C39H70 A2B13C39D70 -579.97 2.25 -8.62 -0.27 0