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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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141213 52839111 1 FO2N4C23H38 AB2C4D23E38 -154.43 4.28 0.0 0.0 0
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141214 52839230 1 FOSN2H17C18 ABCD2E17F18 -11.98 4.96 -9.34 -1.32 0
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141215 52839562 1 FO2N5C19H26 AB2C5D19E26 -87.26 1.94 -8.6 -0.62 0
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141216 52840110 1 SN3O5C17H25 AB3C5D17E25 -146.78 6.4 -9.43 -1.22 0
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141217 52840593 1 SN4O5C22H34 AB4C5D22E34 -230.81 7.15 -9.14 -0.64 0
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141218 52840627 1 SN4O5C20H32 AB4C5D20E32 -235.66 6.59 -9.43 -0.63 0
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141219 52840840 1 O3N5C25H33 A3B5C25D33 -48.71 0.4 -8.63 -1.01 0
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141220 52841206 1 SO2N3C14H17 AB2C3D14E17 -12.02 5.96 -9.08 -0.49 0
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141221 52841207 1 N3O5C16H21 A3B5C16D21 -127.71 4.26 -8.88 -0.18 0
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141222 52841430 1 ClIN3O3H15C16 ABC3D3E15F16 -61.68 7.23 -9.57 -1.59 0
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141223 52842035 1 BrClO2N3C20H23 ABC2D3E20F23 -41.74 2.25 -9.06 -1.31 0
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141224 52842394 1 NO4C18H27 AB4C18D27 -167.63 5.42 -8.99 0.36 0
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141225 52842395 1 NO4C18H27 AB4C18D27 -165.38 5.05 -8.7 0.67 0
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141226 52842472 1 ClN2O4C23H31 AB2C4D23E31 -196.1 3.01 -9.35 -0.38 0
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141227 52842473 1 N2O4C15H26 A2B4C15D26 -195.04 3.76 -9.58 0.67 1
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141228 52842612 1 N3O4C20H36 A3B4C20D36 -168.99 5.62 0.0 0.0 0
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141229 52843149 1 N3O5C21H31 A3B5C21D31 -219.97 4.07 -8.75 -0.03 0
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141230 52843540 1 N2O2F3C19H21 A2B2C3D19E21 -195.99 7.28 -9.45 -0.83 0
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141231 52843570 1 SN2F3O3C19H19 AB2C3D3E19F19 -230.77 7.85 -9.17 -0.5 0
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141232 52843614 1 O2F3N5H16C19 A2B3C5D16E19 -116.51 3.37 -9.69 -1.58 1
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141233 52843783 1 N3O4C24H30 A3B4C24D30 -90.64 0.85 0.0 0.0 0
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141234 52844172 1 ClFN2O2C16H20 ABC2D2E16F20 -142.71 2.37 -9.69 -0.94 0
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141235 52844876 1 SF3O4N5H14C17 AB3C4D5E14F17 -183.51 12.51 -9.61 -1.3 0
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141236 52845036 1 ClN2O3C22H27 AB2C3D22E27 -123.6 6.0 -8.91 -0.46 0
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141237 52845037 1 ClN2O3C22H27 AB2C3D22E27 -126.75 4.62 -9.07 -0.46 0