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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