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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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170299 75215236 1 SN5H21C23 AB5C21D23 154.6 7.16 -9.3 -1.17 0
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170300 75215237 2 OC10H15 AB10C15 -117.37 2.33 -8.4 0.34 0
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170301 75215238 2 OC10H13 AB10C13 -64.25 5.34 -9.24 -1.43 0
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170302 75215269 1 NO7C30H41 AB7C30D41 -277.45 7.56 -8.62 -0.24 0
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170303 75215276 1 O19C41H52 A19B41C52 -782.48 1.91 -9.44 0.25 0
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170304 75215279 1 O6C21H26 A6B21C26 -217.82 3.76 -8.01 -0.11 0
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170305 75215393 1 BrSO4N8C21H21 ABC4D8E21F21 72.58 7.07 -9.01 -1.26 0
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170306 75215394 1 BrSO4N8C21H21 ABC4D8E21F21 63.12 7.19 -8.78 -1.07 0
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170307 75215395 1 BrFSO4N5H11C15 ABCD4E5F11G15 -24.3 4.89 -9.04 -1.98 0
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170308 75215541 2 O2C11H16 A2B11C16 -196.56 3.32 -9.77 0.09 0
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170309 75215542 1 O3C22H32 A3B22C32 -141.74 5.85 -9.29 0.31 0
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170310 75215670 1 N5O6C14H23 A5B6C14D23 -145.65 7.19 -9.25 -1.22 0
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170311 75215914 1 O7C30H38 A7B30C38 -287.25 5.23 -8.84 -0.9 0
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170312 75215927 2 NO2C5H10 AB2C5D10 -202.77 4.64 -9.83 0.44 0
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170313 75216154 1 NO6C25H25 AB6C25D25 -132.28 2.81 -8.09 -1.28 0
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170314 75216185 1 OPN3C20H28 ABC3D20E28 -74.63 5.47 -8.67 0.21 0
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170315 75216186 1 NPO3C29H34 ABC3D29E34 -155.34 2.07 -8.69 -0.14 0
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170316 75216187 1 NOPH30C31 ABCD30E31 -8.07 4.77 -8.52 -0.68 0
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170317 75216462 1 N3O5C22H31 A3B5C22D31 -176.33 8.55 -9.32 -1.14 0
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170318 75216463 4 NOC6H8 ABC6D8 -125.04 6.97 -9.28 -1.16 0
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170319 75216464 1 BrON6H23C24 ABC6D23E24 124.02 4.35 -8.46 -0.82 0
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170320 75216465 1 ClON6H23C24 ABC6D23E24 108.89 3.87 -8.58 -0.93 0
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170321 75216472 1 NO2S2C18H21 AB2C2D18E21 -50.46 4.63 -8.77 -1.7 0
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170322 75216848 3 O2H8C9 A2B8C9 -170.22 4.54 -9.67 -0.78 0
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170323 75216925 1 F3O10N11C41H66 A3B10C11D41E66 -615.23 8.78 -8.7 -1.1 0