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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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185499 77306312 1 O2N8C24H27 A2B8C24D27 57.23 2.42 0.0 0.0 0
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185500 77306325 1 O8H26C27 A8B26C27 -258.73 6.12 -9.15 -0.58 0
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185501 77306711 1 INO3C16H20 ABC3D16E20 -111.36 6.01 -9.65 -0.88 -1
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185502 77307037 1 ClNS2O4H17C21 ABC2D4E17F21 -59.41 6.98 0.0 0.0 0
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185503 77307038 1 ClNS2O4H18C21 ABC2D4E18F21 -76.34 4.39 -9.27 -1.1 0
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185504 77307039 1 FNSO5H20C23 ABCD5E20F23 -182.19 7.55 -9.53 -1.34 0
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185505 77307307 1 NO2C6H7 AB2C6D7 -8.3 5.98 -9.43 -0.07 0
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185506 77308516 2 ClNOC8H12 ABCD8E12 -132.83 5.09 -9.08 -0.31 0
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185507 77308585 1 O2N4C9H16 A2B4C9D16 -65.42 5.27 -9.32 0.2 0
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185508 77308586 1 N3O4C17H25 A3B4C17D25 -169.43 2.18 -9.02 -0.19 0
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185509 77308621 1 NO4C27H29 AB4C27D29 -125.62 6.44 -8.67 -0.63 0
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185510 77308736 1 N2O5C21H22 A2B5C21D22 -106.59 2.2 -8.97 -0.26 0
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185511 77308837 1 BrN4O4C17H25 AB4C4D17E25 -157.81 4.0 -9.52 -0.78 0
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185512 77308838 1 SN3O3C10H15 AB3C3D10E15 -97.96 5.68 -9.43 -0.77 0
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185513 77308839 1 SCl2O3N4C18H26 AB2C3D4E18F26 -124.21 3.36 -9.16 -0.64 0
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185514 77308840 1 N4O4C17H22 A4B4C17D22 -134.83 6.08 -9.77 -0.87 0
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185515 77308966 1 Cl2O2N3C18H19 A2B2C3D18E19 -55.35 5.75 -9.28 -1.17 0
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185516 77308967 1 ClIO2F3N5C28H32 ABC2D3E5F28G32 -176.77 4.28 -9.39 -1.14 0
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185517 77308969 1 SN3O4C30H31 AB3C4D30E31 -103.38 8.54 -8.28 -0.82 0
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185518 77309030 1 ClNO6C19H28 ABC6D19E28 -280.62 4.89 -8.51 -0.2 0
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185519 77309031 1 ClN4C24H25 AB4C24D25 62.95 3.12 -8.35 -0.48 0
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185520 77309032 1 SN2O6C22H32 AB2C6D22E32 -260.62 6.49 -8.91 -0.26 0
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185521 77309477 1 BrFN3O4C29H35 ABC3D4E29F35 -193.72 4.61 -8.3 -0.32 0
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185522 77309671 1 N4O4H20C21 A4B4C20D21 -62.94 5.14 -9.44 -1.0 0
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185523 77309675 1 N2O5C25H30 A2B5C25D30 -157.02 6.8 -7.86 0.03 0
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185524 77310089 1 O2N5C8H11 A2B5C8D11 -11.29 6.0 -9.41 -0.77 0
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185525 77310301 1 N2O3C18H20 A2B3C18D20 -90.46 0.91 -9.15 -0.19 0
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185526 77310493 1 FSCl2O2N5C20H24 ABC2D2E5F20G24 -84.19 3.35 -8.8 -1.41 0
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185527 77310494 1 CuO10N12C30H50 AB10C12D30E50 -279.04 31.97 0.0 0.0 0
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185528 77310495 1 O6N12C23H30 A6B12C23D30 -101.79 7.32 -8.65 -1.88 0
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185529 77310496 1 FPSCl2N3O8C30H39 ABCD2E3F8G30H39 -449.21 6.82 -8.84 -1.08 0
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185530 77310497 1 ClIOSiN3C13H25 ABCDE3F13G25 -69.99 5.06 -8.92 -0.65 0
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185531 77310511 3 ON2C11H14 AB2C11D14 -57.31 7.8 -8.02 -0.28 0
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185532 77310512 1 ON6C22H24 AB6C22D24 71.99 4.74 -8.49 -0.07 0
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185533 77311159 1 N2S2O3C31H44 A2B2C3D31E44 -137.17 3.42 -8.62 -0.29 0
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185534 77311213 1 BrN2O2C7H11 AB2C2D7E11 -108.2 2.13 -10.52 -0.7 0
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185535 77311214 1 SN5O5C29H39 AB5C5D29E39 -196.67 3.75 -8.71 -0.13 0
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185536 77311215 1 Br2N3O9C26H31 A2B3C9D26E31 -367.79 13.04 -9.52 -1.57 0
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185537 77311491 1 BrN5O6H20C22 AB5C6D20E22 -151.48 3.88 -8.59 -1.06 0
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185538 77311866 1 ClN5O5H20C22 AB5C5D20E22 -114.23 5.48 -8.55 -1.34 0
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185539 77311867 1 BrF3O3N4H18C25 AB3C3D4E18F25 -152.2 4.15 -8.84 -1.14 0
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185540 77311868 1 BrO5N6C23H23 AB5C6D23E23 -93.49 4.96 -8.54 -1.22 0
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185541 77311869 1 BrFO4N5H19C25 ABC4D5E19F25 -83.01 7.27 -8.84 -1.19 0
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185542 77311870 1 O5N6H20C26 A5B6C20D26 -29.64 6.11 -8.96 -1.67 0
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185543 77312162 1 ClN2O6C11H17 AB2C6D11E17 -294.82 2.48 -9.44 -0.01 0
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185544 77312163 4 NOC6H6 ABC6D6 -66.13 3.31 -8.55 -0.7 0
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185545 77312164 1 F2N3O5C32H43 A2B3C5D32E43 -265.37 1.6 -9.04 -0.33 0
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185546 77312206 1 FN3O5C21H26 AB3C5D21E26 -189.65 10.64 -8.44 -0.65 0
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185547 77312207 1 ClF2N3O5C19H20 AB2C3D5E19F20 -245.63 7.9 -8.82 -0.89 0
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185548 77312230 1 O4N8C29H36 A4B8C29D36 -49.43 5.29 -8.83 -0.55 0