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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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170074 75193335 1 ClOSN5C29H32 ABCD5E29F32 51.11 9.07 -8.93 -0.64 0
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170075 75193488 1 FSO2N4C29H35 ABC2D4E29F35 -65.35 4.09 -9.11 -0.86 0
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170076 75193767 1 ClF3O3N4H20C24 AB3C3D4E20F24 -200.79 10.61 -9.11 -1.14 0
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170077 75193768 1 ClF3O3N4H18C27 AB3C3D4E18F27 -153.7 8.42 -8.98 -1.39 0
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170078 75193769 1 O3F4N4H18C27 A3B4C4D18E27 -194.66 9.68 -9.05 -1.4 0
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170079 75193834 1 N4O4H26C29 A4B4C26D29 -43.8 5.21 -8.61 -0.9 0
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170080 75193835 1 O3N4H24C28 A3B4C24D28 -5.79 7.08 -8.81 -1.21 0
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170081 75193836 1 ClN4O4H21C23 AB4C4D21E23 -76.04 7.48 -8.87 -1.37 0
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170082 75194024 1 FO3N4H21C23 AB3C4D21E23 -75.22 8.2 -9.04 -0.87 0
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170083 75194289 1 ON3C19H19 AB3C19D19 49.61 3.16 -9.02 -0.9 0
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170084 75194848 1 SN2O5C18H26 AB2C5D18E26 -192.05 5.3 -9.56 -1.21 0
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170085 75194849 1 N3O3C26H27 A3B3C26D27 -41.62 3.81 -8.86 -0.78 0
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170086 75194850 1 ClOSF3N3H9C18 ABCD3E3F9G18 -56.85 4.88 -10.04 -2.25 0
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170087 75194874 1 N2F3O4C18H23 A2B3C4D18E23 -283.69 1.53 -8.58 -0.46 0
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170088 75194921 1 NF2O3H17C18 AB2C3D17E18 -154.3 5.52 -7.83 -0.92 0
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170089 75195068 1 SO3N5H25C27 AB3C5D25E27 5.2 6.63 -9.02 -0.56 0
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170090 75195662 1 S2N3O4H15C17 A2B3C4D15E17 -22.7 4.52 -9.25 -3.12 0
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170091 75195778 1 N2O4C17H18 A2B4C17D18 -102.68 4.1 -8.22 -1.03 0
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170092 75196094 1 O2F3N4C15H19 A2B3C4D15E19 -192.76 8.95 -8.81 -0.38 1
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170093 75196194 1 N2O2C23H27 A2B2C23D27 -28.93 4.73 0.0 0.0 1
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170094 75196195 1 SN2H23C25 AB2C23D25 86.02 3.46 0.0 0.0 1
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170095 75196196 1 SN2C22H23 AB2C22D23 58.71 2.38 0.0 0.0 0
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170096 75196197 1 ClN2S2O3C23H23 AB2C2D3E23F23 -71.28 5.72 -8.1 -0.75 0
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170097 75196530 1 BrNO6H16C20 ABC6D16E20 -138.05 8.0 -9.51 -1.08 0
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170098 75197103 1 ClNSF3O3H7C15 ABCD3E3F7G15 -182.93 3.29 -10.12 -1.84 0
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170099 75197104 1 NSF3O3C15H16 ABC3D3E15F16 -242.81 5.57 -9.8 -1.0 0
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170100 75197188 1 SO2N3C10H13 AB2C3D10E13 0.43 3.13 -9.07 -2.07 0
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170101 75197189 1 ON6C13H16 AB6C13D16 73.6 3.25 -8.52 -0.04 0
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170102 75197568 1 SF3O4N6C18H29 AB3C4D6E18F29 -348.59 10.3 -9.39 -0.53 1
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170103 75197569 1 N3O4C18H18 A3B4C18D18 -78.99 3.21 0.0 0.0 0
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170104 75197570 1 S2N3O5H11C16 A2B3C5D11E16 -55.05 4.78 -9.5 -1.74 0
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170105 75197571 1 N3O3C14H15 A3B3C14D15 -69.15 6.89 -9.76 -0.94 0
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170106 75197572 1 N3O5C13H15 A3B5C13D15 -106.11 5.06 -10.09 -1.42 0
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170107 75197573 1 N3S3O5H17C18 A3B3C5D17E18 -140.3 8.33 -9.08 -1.89 0
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170108 75197574 1 FSO2N6C23H27 ABC2D6E23F27 0.9 5.11 -8.94 -0.75 0
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170109 75197575 1 FSO3N4C23H25 ABC3D4E23F25 -43.4 6.0 -8.93 -0.91 0
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170110 75197576 1 FN3O5H16C20 AB3C5D16E20 -54.42 5.66 -9.56 -1.69 0
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170111 75197577 1 N2O3F4H12C19 A2B3C4D12E19 -197.08 4.91 -10.06 -1.49 0
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170112 75197578 1 N2F3O4H15C20 A2B3C4D15E20 -190.48 8.39 -9.3 -1.23 0
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170113 75197750 1 SN4O4C21H22 AB4C4D21E22 -70.42 6.06 -9.11 -1.95 0
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170114 75198104 1 BrO3N4H21C22 AB3C4D21E22 14.74 8.02 -8.97 -1.07 1
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170115 75198279 1 N3O4C14H14 A3B4C14D14 -79.64 1.57 0.0 0.0 0
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170116 75198280 1 SN3O5C14H23 AB3C5D14E23 -179.85 4.4 -9.44 -0.69 0
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170117 75198281 1 SN2O3C20H24 AB2C3D20E24 -71.26 5.08 -8.96 -0.55 0
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170118 75198499 1 FNO3H18C19 ABC3D18E19 -98.55 4.45 -8.86 -0.64 0
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170119 75198864 1 SO2N3C25H29 AB2C3D25E29 -16.59 2.79 -8.96 -1.79 0
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170120 75198865 1 O2N3C15H19 A2B3C15D19 -34.08 1.43 -9.29 -0.06 0
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170121 75198866 1 S2F3N3O3H16C19 A2B3C3D3E16F19 -198.32 6.34 -9.11 -1.59 0
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170122 75199165 1 SN4O4C26H40 AB4C4D26E40 -165.35 8.62 -8.61 -0.28 0
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170123 75199454 1 O4N5C26H39 A4B5C26D39 -152.71 6.37 -9.44 -0.24 0