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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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170577 75256094 1 SN3O6C25H27 AB3C6D25E27 -176.92 0.75 -8.06 -0.71 1
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170578 75256095 1 SN3O6C25H26 AB3C6D25E26 -171.89 7.7 0.0 0.0 1
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170579 75256152 1 ClSN3O4H21C23 ABC3D4E21F23 -100.08 1.2 0.0 0.0 1
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170580 75256153 1 ClSN3O4H21C23 ABC3D4E21F23 -101.72 2.52 0.0 0.0 0
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170581 75256208 1 FSN3O5H18C22 ABC3D5E18F22 -168.37 3.5 -8.96 -0.9 0
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170582 75256347 1 SF2N3O5H19C23 AB2C3D5E19F23 -227.7 4.66 -9.5 -1.15 0
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170583 75256363 1 SF2N3O3H21C23 AB2C3D3E21F23 -153.15 2.67 -8.87 -0.97 0
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170584 75256584 1 SN5O5C27H29 AB5C5D27E29 -64.34 8.08 -8.6 -0.55 1
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170585 75256585 1 SN5O5C27H30 AB5C5D27E30 -51.54 12.3 0.0 0.0 0
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170586 75256613 1 SO3N5C29H33 AB3C5D29E33 -10.63 11.56 -8.6 -0.95 0
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170587 75256625 1 SO3N5C28H33 AB3C5D28E33 22.26 13.11 -6.99 -1.21 0
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170588 75256626 1 SO3N5C28H33 AB3C5D28E33 5.07 8.76 -8.14 -1.06 0
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170589 75256627 1 ClSO2N5H26C28 ABC2D5E26F28 113.2 29.68 -6.49 -1.96 0
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170590 75256905 1 SO3N5C20H21 AB3C5D20E21 -3.85 8.4 -8.75 -0.62 0
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170591 75257355 1 FO2N4C20H25 AB2C4D20E25 -60.06 6.97 -9.0 -0.24 0
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170592 75257644 1 NO3C21H25 AB3C21D25 -22.9 4.32 -9.58 -0.63 0
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170593 75258297 1 O2N5C20H27 A2B5C20D27 -41.29 3.14 -8.95 -0.54 0
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170594 75258298 1 ON5H13C16 AB5C13D16 85.23 4.84 -9.17 -1.57 0
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170595 75258299 1 O2N4C23H30 A2B4C23D30 -36.9 4.83 -9.05 -0.31 0
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170596 75258300 1 N2O3C15H26 A2B3C15D26 -155.16 7.66 -8.85 0.31 0
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170597 75258301 1 ON5H19C20 AB5C19D20 118.53 7.5 -9.68 -1.53 0
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170598 75258302 1 N2O4C21H24 A2B4C21D24 -131.22 4.54 -9.1 -0.3 0
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170599 75258357 1 ON4C20H20 AB4C20D20 77.42 5.71 -9.12 -1.65 0
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170600 75258530 1 O2N4C15H20 A2B4C15D20 -19.15 1.84 -9.33 -1.41 0
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170601 75258531 1 N3O3H21C22 A3B3C21D22 -54.71 7.17 -9.07 -1.05 0
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170602 75258624 1 SO2N5C19H25 AB2C5D19E25 -43.47 2.67 -9.02 -0.52 0
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170603 75258625 1 OSN5C13H17 ABC5D13E17 25.77 4.41 -9.37 -0.83 0
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170604 75258626 1 N2O3C17H22 A2B3C17D22 -81.76 3.91 -9.51 -0.92 0
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170605 75258627 1 O3N4C20H24 A3B4C20D24 -81.38 3.39 -8.76 -0.86 0
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170606 75258628 1 FON3C21H24 ABC3D21E24 27.66 4.89 -8.78 0.15 0
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170607 75258629 1 O2N5C22H29 A2B5C22D29 2.48 2.37 -8.72 0.24 0
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170608 75258630 1 FN5C16H22 AB5C16D22 28.67 1.41 -8.95 -0.08 0
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170609 75258631 1 OSN4C15H20 ABC4D15E20 18.26 5.14 -9.04 -0.71 0
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170610 75258632 1 ClFO2N4H10C15 ABC2D4E10F15 -10.26 9.09 -9.48 -1.44 0
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170611 75258633 1 ClO3N4C15H19 AB3C4D15E19 -44.27 5.16 -9.78 -0.64 0
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170612 75258634 1 ON3C20H33 AB3C20D33 -55.66 5.04 -8.63 -0.01 0
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170613 75258635 1 SO2N4C16H20 AB2C4D16E20 -11.31 2.29 -8.96 -0.94 0
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170614 75258636 1 FOSN3C15H20 ABCD3E15F20 -47.06 2.81 -8.98 -0.1 0
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170615 75258637 1 ClN2O2C19H25 AB2C2D19E25 -87.35 2.41 -9.47 -0.12 0
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170616 75258894 1 ClOS2N4C13H19 ABC2D4E13F19 8.55 2.24 -9.0 -0.39 0
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170617 75258895 1 N4O4C17H22 A4B4C17D22 -178.06 3.73 -8.46 -0.44 0
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170618 75259075 1 O2N3C23H35 A2B3C23D35 -103.12 5.92 -8.9 0.02 0
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170619 75259270 1 FN6C18H21 AB6C18D21 78.82 3.04 -8.91 -0.72 0
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170620 75259271 1 OSN6C11H12 ABC6D11E12 64.86 5.49 -8.84 -1.36 0
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170621 75260005 1 O2N5C27H37 A2B5C27D37 -29.73 3.89 -7.87 0.21 0
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170622 75260231 1 FON3C19H32 ABC3D19E32 -91.25 3.79 -8.7 -0.01 0
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170623 75260232 1 OF2N3C19H31 AB2C3D19E31 -135.05 4.86 -8.73 -0.29 0
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170624 75260233 1 N4O4C23H30 A4B4C23D30 -113.2 4.76 -8.43 -0.4 0
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170625 75260416 1 O2N6C19H26 A2B6C19D26 -4.34 5.79 -8.8 -0.99 0
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170626 75260846 1 O3N8C19H24 A3B8C19D24 2.98 5.34 -9.72 -1.38 0