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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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190219 77971032 1 SN5O5C15H21 AB5C5D15E21 -170.78 2.69 -8.86 -1.13 0
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190220 77971033 1 O4N5C14H19 A4B5C14D19 -107.03 4.9 -8.85 -0.93 0
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190221 77971034 1 NO3C17H23 AB3C17D23 -105.51 3.03 -8.17 0.27 0
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190222 77971035 1 NO5C25H29 AB5C25D29 -157.12 2.74 -8.1 -0.45 0
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190223 77971454 1 O2N3C25H25 A2B3C25D25 10.19 9.73 -9.01 -1.31 0
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190224 77971455 1 O3N5C32H33 A3B5C32D33 75.9 9.19 -8.78 -1.62 0
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190225 77972447 3 NOC9H11 ABC9D11 -88.03 3.61 -8.09 -0.39 0
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190226 77972847 1 O4N5C25H37 A4B5C25D37 -151.66 8.76 -8.64 -0.8 0
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190227 77972899 1 FN4O7C28H31 AB4C7D28E31 -254.08 2.71 -9.37 -0.91 0
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190228 77972900 1 SN2O4C15H16 AB2C4D15E16 -95.63 9.92 -9.37 -1.16 0
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190229 77972901 1 O2Cl4N4C23H26 A2B4C4D23E26 -73.01 7.08 -9.18 -1.0 0
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190230 77973014 1 ClSO2N6C26H29 ABC2D6E26F29 29.43 9.05 -8.46 -2.17 0
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190231 77973360 1 ClO3N4C27H35 AB3C4D27E35 -59.76 5.02 -8.65 -0.4 0
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190232 77973391 1 Cl2O3N4C28H34 A2B3C4D28E34 -64.62 6.02 -8.51 -0.42 0
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190233 77973574 1 NSC15H19 ABC15D19 27.96 1.73 -8.97 -0.61 0
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190234 77974115 1 N5O5C32H43 A5B5C32D43 -213.04 3.55 -8.63 -0.12 0
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190235 77974477 1 FO3C24H25 AB3C24D25 -129.15 3.19 -8.72 -0.93 0
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190236 77974683 1 ClO6N7C23H30 AB6C7D23E30 -157.57 10.59 -9.68 -1.55 0
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190237 77974684 1 O6N7C23H29 A6B7C23D29 -121.08 7.93 -9.51 -1.21 0
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190238 77974685 1 NSO4C9H9 ABC4D9E9 -119.8 2.06 -9.02 -0.97 0
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190239 77974993 1 NSO6C22H27 ABC6D22E27 -222.09 3.13 -9.53 -1.56 0
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190240 77975152 1 O5C23H46 A5B23C46 -315.65 1.15 -10.01 1.22 0
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190241 77975280 1 O4N6C11H18 A4B6C11D18 -66.47 6.33 -9.74 -0.72 0
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190242 77975706 1 ON3C15H15 AB3C15D15 33.37 2.49 -9.39 -0.49 0
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190243 77975934 1 O3C22H34 A3B22C34 -88.23 9.26 -6.58 -0.15 1