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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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174038 75714385 1 SN2O5C25H32 AB2C5D25E32 -171.3 5.76 -8.94 -0.45 0
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174039 75714398 1 N2O3C22H34 A2B3C22D34 -130.81 0.94 -9.01 -0.02 0
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174040 75714399 2 NOC14H19 ABC14D19 -69.01 4.96 -9.18 0.1 0
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174041 75714400 2 NOC15H20 ABC15D20 -67.55 6.21 -9.12 0.18 0
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174042 75714604 1 Cl2N2O2C25H40 A2B2C2D25E40 -152.29 1.04 -9.39 -0.66 0
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174043 75715134 1 BrN2O3C22H27 AB2C3D22E27 -105.49 1.55 -8.89 -0.26 0
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174044 75715151 1 BrN2O4C24H27 AB2C4D24E27 -122.49 8.59 -9.09 -0.49 0
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174045 75715463 1 N2O3C25H28 A2B3C25D28 -58.37 3.71 -9.25 -0.47 0
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174046 75715573 1 SN2O7H22C23 AB2C7D22E23 -180.12 8.24 -8.95 -0.68 0
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174047 75715574 1 N2O5C21H24 A2B5C21D24 -148.32 2.87 -8.78 -0.59 0
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174048 75715661 1 ClN2O2C19H29 AB2C2D19E29 -111.29 2.43 -9.37 -0.46 0
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174049 75715662 1 ClN2O3C18H21 AB2C3D18E21 -97.87 3.69 -9.43 -0.7 0
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174050 75715672 1 ClN2O4C24H29 AB2C4D24E29 -134.9 3.13 -8.35 -0.41 0
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174051 75715798 1 ClN3O4C18H26 AB3C4D18E26 -104.1 3.86 -9.93 -1.94 0
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174052 75715837 1 N2O3C17H24 A2B3C17D24 -117.89 1.47 -9.13 -0.13 0
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174053 75715838 1 N2O3C19H30 A2B3C19D30 -138.59 3.46 -8.82 0.16 0
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174054 75715938 1 F3N3O5C23H24 A3B3C5D23E24 -265.36 6.57 -9.86 -1.27 0
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174055 75716058 1 N3O5C19H25 A3B5C19D25 -130.96 4.36 -9.89 -1.4 -1
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174056 75716077 1 N3O6C25H32 A3B6C25D32 -130.15 8.3 0.0 0.0 0
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174057 75716078 1 N3O6C25H33 A3B6C25D33 -171.09 8.55 -9.25 -1.18 0
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174058 75716760 1 Cl2N3O4C21H23 A2B3C4D21E23 -80.42 7.28 -9.85 -1.47 0
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174059 75716863 1 N2O3C27H38 A2B3C27D38 -127.09 3.73 -8.8 0.12 0
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174060 75717525 2 NOC11H14 ABC11D14 -77.32 1.57 -9.13 -0.09 0
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174061 75717755 1 SN3O6C22H25 AB3C6D22E25 -128.62 11.18 -9.7 -1.48 0
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174062 75717756 1 N3O4C20H27 A3B4C20D27 -94.06 8.67 -9.58 -1.27 0
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174063 75717881 2 NOC9H17 ABC9D17 -152.62 0.41 -9.24 0.91 0
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174064 75717882 2 NOC10H20 ABC10D20 -170.27 4.22 -9.25 0.82 0
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174065 75718048 1 ClN3O4C15H20 AB3C4D15E20 -92.68 6.27 -10.12 -1.5 0
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174066 75718358 1 N2O3C23H38 A2B3C23D38 -166.18 3.06 -9.08 -0.05 0
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174067 75718359 1 N2O3C19H30 A2B3C19D30 -151.29 2.27 -9.08 -0.06 0
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174068 75718360 1 N2O3C19H30 A2B3C19D30 -156.2 3.84 -9.18 -0.12 0
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174069 75718419 2 NOC9H17 ABC9D17 -134.81 2.15 -9.42 0.54 0
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174070 75719016 2 NOC8H13 ABC8D13 -92.96 3.78 -9.13 0.51 0
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174071 75719017 2 NOC9H16 ABC9D16 -114.23 2.72 -9.29 0.37 0
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174072 75719233 1 N3O5C19H23 A3B5C19D23 -189.2 2.34 -9.3 -0.78 0
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174073 75720221 1 ClN2O4C27H29 AB2C4D27E29 -104.57 7.36 -8.5 -0.44 0
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174074 75720222 1 ClN2O6C26H27 AB2C6D26E27 -214.95 7.09 -9.1 -0.5 0
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174075 75720223 1 ClN2O6C28H29 AB2C6D28E29 -208.84 8.54 -9.01 -0.22 0
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174076 75720421 1 ClN2O2C27H35 AB2C2D27E35 -104.45 4.17 -9.14 -0.15 0
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174077 75720703 1 ClN2O2C31H41 AB2C2D31E41 -83.74 4.09 -9.0 -0.44 0
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174078 75720712 1 ClN2O2C28H41 AB2C2D28E41 -110.47 3.46 -9.44 -0.36 0
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174079 75720886 1 ClN2O3C28H39 AB2C3D28E39 -125.19 4.37 -9.25 -0.41 0
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174080 75720887 1 ClN2O3C24H31 AB2C3D24E31 -102.46 4.51 -9.34 -0.43 0
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174081 75721003 1 N2O2Cl3C26H33 A2B2C3D26E33 -111.09 5.91 -9.3 -0.78 0
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174082 75721540 1 ClN2O4C24H25 AB2C4D24E25 -93.78 5.08 -8.93 -0.35 0
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174083 75721567 1 Cl2N2O3C29H32 A2B2C3D29E32 -106.88 3.79 -9.11 -0.78 0
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174084 75721568 1 Cl2N2O3H24C25 A2B2C3D24E25 -74.37 6.05 -8.93 -0.5 0
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174085 75721569 1 Cl2N2O3H24C25 A2B2C3D24E25 -89.43 3.58 -9.02 -0.73 0
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174086 75721797 1 ClN3O5C27H28 AB3C5D27E28 -106.15 3.5 -9.25 -1.32 0
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174087 75721807 1 ClN3O5C28H28 AB3C5D28E28 -95.47 7.94 -9.62 -1.1 0