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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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357485 127294118 1 N3O4C22H29 A3B4C22D29 -147.37 1.74 -8.35 -0.04 0
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357486 127294119 1 N3O5C18H21 A3B5C18D21 -185.37 3.18 -8.36 -0.08 0
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357487 127294120 1 SN3O4C18H25 AB3C4D18E25 -161.47 5.74 -9.42 -0.2 0
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357488 127294121 3 NO2C6H7 AB2C6D7 -217.69 1.97 -8.47 -0.18 0
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357489 127294122 1 N4O4C21H24 A4B4C21D24 -113.23 2.62 -8.35 -0.04 0
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357490 127294123 1 N4O4C21H24 A4B4C21D24 -111.99 4.47 -8.49 -0.2 0
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357491 127294124 1 FON5C22H24 ABC5D22E24 0.15 8.56 -9.08 -0.75 0
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357492 127294125 1 BrSO2N4C15H19 ABC2D4E15F19 1.27 3.76 -9.3 -0.57 0
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357493 127294126 1 O2N6C17H20 A2B6C17D20 45.48 2.47 -8.75 -0.49 0
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357494 127294127 2 ClON2C9H10 ABC2D9E10 0.26 3.8 -9.39 -0.57 0
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357495 127294128 1 N3O5C18H21 A3B5C18D21 -183.41 5.11 -8.57 -0.29 0
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357496 127294129 1 N4O5H18C20 A4B5C18D20 -88.17 8.19 -8.68 -0.98 0
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357497 127294130 1 N4O5C19H22 A4B5C19D22 -131.33 3.44 -8.4 -0.34 0
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357498 127294131 1 N2O5C22H22 A2B5C22D22 -160.43 4.16 -8.18 -0.24 0
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357499 127294132 1 N4O4C19H20 A4B4C19D20 -84.96 5.39 -8.5 -0.27 0
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357500 127294133 1 N2O5C20H26 A2B5C20D26 -203.33 4.21 -8.54 -0.27 0
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357501 127294134 1 N2O5C19H24 A2B5C19D24 -186.35 2.0 -8.29 0.01 0
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357502 127294135 1 N4O4C21H24 A4B4C21D24 -119.26 6.09 -8.41 -0.12 0
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357503 127294136 1 N3O4C21H29 A3B4C21D29 -149.53 0.85 -8.35 -0.06 0
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357504 127294137 1 O4N5C20H23 A4B5C20D23 -102.83 4.82 -8.57 -0.28 0
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357505 127294138 1 N3O5C18H21 A3B5C18D21 -176.07 2.22 -8.35 -0.03 0
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357506 127294139 1 F2N4O4C17H18 A2B4C4D17E18 -237.35 4.82 -9.58 -0.64 0
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357507 127294140 1 N2O5C19H24 A2B5C19D24 -188.34 2.57 -8.35 -0.06 0
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357508 127294141 1 SN3O4C19H21 AB3C4D19E21 -117.19 2.04 -8.44 -0.48 0
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357509 127294142 1 N4O4C21H24 A4B4C21D24 -113.92 3.86 -8.43 -0.14 0
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357510 127294143 4 NOC5H6 ABC5D6 -113.67 4.3 -8.44 -0.16 0
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357511 127294144 1 N3O4C20H27 A3B4C20D27 -127.6 3.51 -8.46 -0.19 0
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357512 127294145 1 N2O4C21H26 A2B4C21D26 -138.86 4.93 -8.2 0.16 0
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357513 127294146 1 F2N3O3C20H23 A2B3C3D20E23 -199.97 2.9 -9.53 -0.67 0
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357514 127294147 1 SN2O3C21H30 AB2C3D21E30 -116.77 9.13 -9.02 0.39 0
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357515 127294148 1 O2N5C22H31 A2B5C22D31 -49.76 2.76 -8.82 -0.3 0
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357516 127294149 1 O2N5C19H23 A2B5C19D23 4.01 3.45 -8.74 -0.22 0
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357517 127294150 1 O2N5C21H29 A2B5C21D29 -43.35 3.93 -8.9 -0.38 0
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357518 127294151 1 O2N5C22H31 A2B5C22D31 -38.73 4.13 -8.74 -0.23 0
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357519 127294152 1 N3O4C20H27 A3B4C20D27 -143.34 4.11 -8.19 0.12 0
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357520 127294153 1 SN3O3C20H31 AB3C3D20E31 -116.99 10.4 -8.95 0.41 0
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357521 127294154 1 O3N5C19H23 A3B5C19D23 -29.97 6.53 -9.24 -1.17 0
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357522 127294155 1 N4O4C21H24 A4B4C21D24 -99.04 1.72 -8.32 -0.04 0
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357523 127294156 1 FON5C22H24 ABC5D22E24 14.08 6.08 -8.85 -0.64 0
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357524 127294157 1 O3N5C21H27 A3B5C21D27 -47.31 4.84 -9.11 -1.2 0
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357525 127294158 1 O2N5C21H29 A2B5C21D29 -43.0 4.38 -8.84 -0.32 0
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357526 127294159 1 SN2O4C18H22 AB2C4D18E22 -145.55 3.51 -8.45 -0.16 0
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357527 127294160 1 SF2N3O3C17H19 AB2C3D3E17F19 -202.34 2.21 -8.93 -0.73 0
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357528 127294173 1 O2N5C19H21 A2B5C19D21 2.55 7.83 -9.28 -0.97 0
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357529 127294174 1 ON7C21H27 AB7C21D27 67.62 10.02 -9.62 -1.05 0
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357530 127294175 1 O3N4C19H22 A3B4C19D22 -73.49 3.47 -8.99 -0.7 0
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357531 127294176 2 ON2C11H14 AB2C11D14 -62.92 2.67 -8.81 -0.09 0
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357532 127294177 1 O3N5C19H27 A3B5C19D27 -93.89 4.04 -8.93 0.0 0
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357533 127294178 1 O2N3C21H25 A2B3C21D25 -28.84 1.36 -8.93 -0.2 0
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357534 127294197 1 N3O4C22H29 A3B4C22D29 -151.67 1.57 -8.46 -0.15 0