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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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292550 115472983 1 ClN3C17H24 AB3C17D24 -6.31 5.16 -8.89 -0.39 0
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292551 116669170 1 OSN5C14H19 ABC5D14E19 -3.69 6.68 -8.42 -0.38 0
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292552 116933579 2 NC7H12 AB7C12 -19.76 1.51 -8.73 0.46 0
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292553 116933580 1 ON2C14H24 AB2C14D24 -48.07 1.85 -8.53 0.53 0
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292554 116933583 1 BrSN2C9H15 ABC2D9E15 9.74 2.04 -9.37 -0.67 0
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292555 116933584 1 ClON2C12H19 ABC2D12E19 -48.38 4.6 -9.04 -0.3 0
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292556 116933585 2 NOC7H12 ABC7D12 -72.29 1.31 -8.08 0.3 0
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292557 116933586 2 NOC7H11 ABC7D11 -72.48 1.6 -8.39 0.22 0
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292558 116933587 1 O2N3C13H19 A2B3C13D19 -72.76 2.52 -8.96 -0.6 0
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292559 116933588 1 O2N3C14H21 A2B3C14D21 -72.0 2.74 -8.77 -0.46 0
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292560 116933589 1 O2N3C14H21 A2B3C14D21 -76.41 3.7 -8.71 -0.35 0
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292561 116933590 1 N2C15H26 A2B15C26 -22.65 1.61 -8.9 0.42 0
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292562 116933591 1 ON2C14H22 AB2C14D22 -47.66 3.9 -8.61 0.22 0
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292563 116933594 1 ClFN2C11H16 ABC2D11E16 -53.89 2.8 -9.46 -0.59 0
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292564 116933598 1 SN2C14H24 AB2C14D24 -10.73 3.02 -8.5 -0.01 0
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292565 116933600 1 ON2C14H24 AB2C14D24 -54.72 1.78 -8.65 0.47 0
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292566 116933601 2 NC8H14 AB8C14 -27.71 1.52 -8.85 0.46 0
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292567 116933602 1 ON3C12H17 AB3C12D17 -4.94 1.68 -9.44 -0.79 0
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292568 116933603 1 ON3C13H19 AB3C13D19 -12.44 2.83 -9.13 -0.42 0
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292569 116933604 1 ON4C12H18 AB4C12D18 -33.37 2.55 -8.85 -0.41 0
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292570 116933605 2 N2C6H9 A2B6C9 29.69 3.53 -9.11 -0.42 0
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292571 116933606 1 N4C13H20 A4B13C20 22.39 4.97 -8.73 -0.08 0
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292572 116933607 1 N4C13H20 A4B13C20 29.15 6.7 -8.88 -0.31 0
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292573 116933760 1 ON3C12H17 AB3C12D17 -3.92 3.56 -9.11 -0.37 0
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292574 117355876 1 N3C15H19 A3B15C19 48.72 3.33 -8.8 0.3 0
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292575 117355878 1 N3C15H19 A3B15C19 43.98 1.71 -8.38 0.24 0
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292576 117355884 1 NSO2C12H19 ABC2D12E19 -91.38 6.54 -9.4 0.01 0
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292577 117355885 1 NSO2C12H19 ABC2D12E19 -91.09 6.38 -9.34 0.02 0
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292578 117355886 1 NSO2C12H19 ABC2D12E19 -62.74 2.42 -8.26 -0.18 0
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292579 117355887 1 NSO2C12H19 ABC2D12E19 -70.1 1.87 -8.52 -0.28 0
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292580 117355892 1 NSO2C12H19 ABC2D12E19 -64.56 4.16 -8.17 -0.11 0
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292581 117355897 1 NSO2C12H19 ABC2D12E19 -88.31 8.61 -9.53 -0.26 0
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292582 117355898 1 NSO2C12H19 ABC2D12E19 -88.59 5.55 -9.33 -0.26 0
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292583 117355900 1 NSO2C12H19 ABC2D12E19 -67.37 1.42 -8.25 0.06 0
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292584 117355901 1 NSO2C12H19 ABC2D12E19 -61.59 3.94 -8.13 0.0 0
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292585 117355904 1 NSO2C12H19 ABC2D12E19 -66.52 1.81 -8.05 -0.11 0
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292586 117355906 1 NSO2C12H19 ABC2D12E19 -64.83 3.26 -8.3 -0.04 0
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292587 117355908 1 NSO2C12H19 ABC2D12E19 -92.48 7.27 -9.26 -0.36 0
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292588 117355911 1 NSO2C12H19 ABC2D12E19 -62.08 2.69 -8.24 -0.17 0
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292589 117355913 1 NSO2C12H19 ABC2D12E19 -60.31 1.89 -8.15 -0.04 0
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292590 117355918 1 NSO2C12H19 ABC2D12E19 -69.36 4.23 -8.3 -0.04 0
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292591 117355923 1 NSO2C12H19 ABC2D12E19 -61.59 2.87 -8.17 0.02 0
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292592 117355930 1 NSO2C12H19 ABC2D12E19 -84.13 5.03 -9.33 -0.35 0
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292593 117355932 1 NSO2C12H19 ABC2D12E19 -85.01 6.94 -9.53 -0.3 0
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292594 117355938 1 NSO2C12H19 ABC2D12E19 -85.19 5.87 -9.56 -0.4 0
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292595 117355939 1 NSO2C12H19 ABC2D12E19 -86.93 4.16 -9.48 -0.32 0
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292596 117355943 1 NOS2C11H15 ABC2D11E15 -7.63 2.87 -8.72 -0.51 0
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292597 117355944 1 NOS2C11H15 ABC2D11E15 -6.58 2.98 -8.41 -0.84 0
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292598 117355946 1 NOS2C11H15 ABC2D11E15 -13.27 1.46 -8.69 -0.62 0
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292599 117355949 1 NC17H23 AB17C23 12.47 4.04 -9.72 -0.48 0