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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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194195 78497032 1 SN3O4C16H21 AB3C4D16E21 -145.38 4.89 -9.01 -0.33 0
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194196 78497033 1 SN3O3C13H19 AB3C3D13E19 -111.79 3.85 -9.12 -0.14 0
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194197 78497034 1 SO2N3C16H23 AB2C3D16E23 -84.54 5.47 -9.12 -0.1 0
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194198 78497035 1 SN3O4C18H27 AB3C4D18E27 -162.34 6.18 -8.35 -0.16 0
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194199 78497036 1 O2S2N4C15H18 A2B2C4D15E18 -44.42 2.02 -9.18 -0.8 0
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194200 78497037 2 OSN2C8H10 ABC2D8E10 -55.24 5.28 -9.16 -0.83 0
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194201 78497038 1 O2S2N4C11H16 A2B2C4D11E16 -65.84 2.92 -9.13 -0.69 0
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194202 78497039 2 OSN2C6H9 ABC2D6E9 -66.74 4.84 -9.22 -0.72 0
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194203 78497040 1 O2S2N5C11H17 A2B2C5D11E17 -58.01 5.82 -9.45 -0.78 0
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194204 78497085 1 SN2O3C10H18 AB2C3D10E18 -144.0 1.85 -8.96 0.19 0
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194205 78497086 1 SN2O3C12H22 AB2C3D12E22 -153.73 6.1 -9.04 0.13 0
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194206 78497207 1 SN2F3O3C14H17 AB2C3D3E14F17 -263.4 3.63 -9.1 -0.68 0
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194207 78497453 1 FNO2H12C17 ABC2D12E17 -20.13 4.71 -9.63 -1.15 -1
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194208 78497558 1 O4N6C13H19 A4B6C13D19 -37.93 5.46 0.0 0.0 1
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194209 78497572 1 FNO3C24H31 ABC3D24E31 -123.42 6.98 0.0 0.0 -1
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194210 78497573 1 N2O3C13H17 A2B3C13D17 -111.38 4.25 0.0 0.0 0
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194211 78498077 1 N3O6C18H25 A3B6C18D25 -261.9 4.21 -9.56 -0.35 0
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194212 78498138 1 FN2O4C17H17 AB2C4D17E17 -88.75 4.77 -9.35 -1.51 0
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194213 78498511 1 SN2O3H16C17 AB2C3D16E17 -36.84 3.31 -9.29 -1.74 0
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194214 78498526 1 ClSN2O3C20H21 ABC2D3E20F21 -91.0 3.94 -8.46 -1.35 0
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194215 78498802 1 OS2N6H14C16 AB2C6D14E16 119.27 8.2 -8.91 -2.11 0
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194216 78499475 1 F3O3N4C18H21 A3B3C4D18E21 -241.06 3.89 -9.49 -0.88 0
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194217 78500674 1 SO3N4C21H24 AB3C4D21E24 -19.75 7.53 -8.36 -0.47 0
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194218 78500675 1 F2N2O5H18C20 A2B2C5D18E20 -248.46 5.04 -8.64 -0.68 0
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194219 78500726 1 O3N4C23H26 A3B4C23D26 -51.87 2.4 -9.07 -1.7 0
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194220 78500873 2 NO2C9H11 AB2C9D11 -122.86 1.51 -9.17 -0.77 0
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194221 78501003 1 SF2N3O4H15C18 AB2C3D4E15F18 -150.22 6.71 -9.3 -1.28 0
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194222 78501007 1 OSN3C21H27 ABC3D21E27 15.44 5.15 -8.37 -1.43 0
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194223 78501045 1 SN2O2C25H34 AB2C2D25E34 -88.98 9.14 -9.05 -0.93 0
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194224 78501046 1 SO2N4H18C21 AB2C4D18E21 29.73 4.0 -8.78 -1.79 0
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194225 78501062 1 SO2N3C23H23 AB2C3D23E23 30.69 4.56 -8.35 -1.37 0
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194226 78501079 1 SN2O4C22H26 AB2C4D22E26 -167.72 4.45 -8.71 -0.52 0
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194227 78501080 1 NO4C17H19 AB4C17D19 -114.1 1.28 -9.24 -0.57 0
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194228 78501081 1 SN2O3C21H22 AB2C3D21E22 -80.87 5.29 -9.0 -1.0 0
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194229 78501196 2 NO2C8H12 AB2C8D12 -156.78 2.63 -9.94 -0.74 0
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194230 78501372 1 N2S2O3H12C15 A2B2C3D12E15 -40.64 2.49 -8.91 -1.13 3
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194231 78502095 1 N7C20H34 A7B20C34 116.54 18.3 0.0 0.0 0
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194232 78502096 1 N2O3C18H22 A2B3C18D22 -102.54 5.08 -8.6 -0.43 0
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194233 78502097 1 N2O3C19H26 A2B3C19D26 -141.04 5.07 -9.55 -0.33 -1
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194234 78502420 1 N5O5C13H14 A5B5C13D14 -143.52 4.24 0.0 0.0 0
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194235 78502468 1 SO2N3C15H17 AB2C3D15E17 -1.78 4.97 -9.13 -1.02 0
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194236 78502655 1 N2O5C24H26 A2B5C24D26 -149.93 3.56 -9.6 -1.26 0
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194237 78502672 1 N2O5C19H22 A2B5C19D22 -200.82 4.44 -8.79 -0.49 0
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194238 78502673 1 ClN3O5C17H18 AB3C5D17E18 -186.53 2.99 -9.48 -0.96 0
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194239 78502764 1 ClFSO2N3H17C19 ABCD2E3F17G19 -47.9 5.34 -9.35 -1.31 0
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194240 78503080 1 NO4C20H23 AB4C20D23 -153.04 4.73 -9.11 -0.56 0
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194241 78503454 1 FOSN5C16H20 ABCD5E16F20 -8.99 7.88 -9.72 -1.35 0
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194242 78503455 1 FOSN5C17H22 ABCD5E17F22 -9.59 1.71 -9.4 -1.16 0
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194243 78503456 1 FSO2N5H14C15 ABC2D5E14F15 3.54 3.79 -9.34 -1.38 0
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194244 78503457 1 FSO3N6C16H17 ABC3D6E16F17 -74.14 7.12 -9.54 -1.2 0