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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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164320 74382869 1 SiO4C42H56 AB4C42D56 -168.9 4.66 -8.88 0.19 0
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164321 74382872 1 SiO2C17H26 AB2C17D26 -86.49 2.93 -9.34 0.37 0
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164322 74382891 1 O4N5C26H33 A4B5C26D33 -89.38 5.99 -8.67 -0.88 0
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164323 74382892 1 ClO4N5C32H34 AB4C5D32E34 -65.7 2.85 -8.7 -0.89 0
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164324 74382894 1 SN7O8C44H49 AB7C8D44E49 -189.41 7.45 -8.61 -1.3 0
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164325 74382898 1 ON3C14H21 AB3C14D21 -3.2 4.5 -8.84 0.07 0
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164326 74382899 1 N3H25C26 A3B25C26 143.04 3.82 -8.02 0.05 0
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164327 74382901 1 S2O13N18C56H86 A2B13C18D56E86 -537.66 7.43 -8.94 -0.35 0
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164328 74382902 1 SN11O12C38H57 AB11C12D38E57 -510.78 13.54 -8.64 -0.43 0
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164329 74382947 1 ClS2O5N7C27H38 AB2C5D7E27F38 -158.1 9.18 -9.09 -0.76 0
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164330 74382964 1 FO5N10C34H43 AB5C10D34E43 -200.42 2.81 -8.54 -0.14 0
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164331 74382982 1 NSO3C26H31 ABC3D26E31 -87.6 3.45 -9.48 -1.17 0
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164332 74382988 1 N2O5H26C28 A2B5C26D28 -118.13 3.19 -9.46 -0.32 0
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164333 74383012 1 FCl2O3N5C30H38 AB2C3D5E30F38 -168.01 3.08 -8.83 -0.83 0
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164334 74383014 1 OSiN3C27H37 ABC3D27E37 -29.31 3.35 -8.56 0.16 0
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164335 74383021 1 O6N7C37H55 A6B7C37D55 -270.91 6.81 -9.08 0.13 0
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164336 74383022 1 O4N9C36H55 A4B9C36D55 -153.82 2.84 -9.02 0.29 0
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164337 74383024 1 N12O13C59H106 A12B13C59D106 -602.43 19.8 -8.85 -1.59 0
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164338 74383025 1 ClO2F3N4C23H24 AB2C3D4E23F24 -147.12 6.48 -8.96 -1.27 0
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164339 74383031 1 ON3C23H23 AB3C23D23 21.86 1.05 -8.67 -0.43 0
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164340 74383032 1 OSN2H22C23 ABC2D22E23 23.14 2.79 -8.85 -0.82 0
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164341 74383041 1 F2N3O3C29H37 A2B3C3D29E37 -227.6 3.57 -9.07 -0.51 0
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164342 74383132 1 O3N6C25H32 A3B6C25D32 -46.84 4.95 -8.63 -0.85 0
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164343 74383416 1 ClF3N4O6C27H28 AB3C4D6E27F28 -294.8 6.76 -8.98 -1.65 0
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164344 74383417 1 ClF3N4O6C26H28 AB3C4D6E26F28 -322.75 9.07 -8.98 -1.34 0
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164345 74383418 1 ClF3N4O5C31H32 AB3C4D5E31F32 -250.21 5.25 -9.03 -1.32 0
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164346 74383515 2 O4N5C18H33 A4B5C18D33 -441.3 4.54 -9.29 0.04 0
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164349 74384796 1 SF3O6C22H31 AB3C6D22E31 -414.66 4.56 -9.29 -1.37 0
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164350 74384797 1 SO2N5H17C25 AB2C5D17E25 126.95 7.72 -8.47 -1.23 0
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164351 74386079 2 ON2C9H12 AB2C9D12 -29.23 6.37 -8.99 -0.15 0
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164352 74386807 1 N2O3F4C26H28 A2B3C4D26E28 -277.78 5.7 -8.45 -0.57 0
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164353 74387024 1 SF2O3H6C8 AB2C3D6E8 -191.52 3.87 -10.51 -1.03 0
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164354 74387300 1 SF3N3O3H22C26 AB3C3D3E22F26 -176.19 5.36 -9.44 -1.46 0
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164355 74387594 1 O4N7C27H41 A4B7C27D41 -83.66 4.07 -8.45 -1.65 0
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164356 74387665 1 N2O5F10H30C34 A2B5C10D30E34 -685.19 7.75 -9.64 -1.36 0
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164357 74387722 1 OF2N2C28H32 AB2C2D28E32 -107.81 4.32 -8.88 -0.94 0
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164358 74387723 1 OF2N2C28H30 AB2C2D28E30 -74.2 3.72 -8.8 -0.69 0
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164359 74387943 1 N2O4C29H34 A2B4C29D34 -133.75 1.77 -8.23 -0.12 0
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164360 74388043 1 NO3F10H25C34 AB3C10D25E34 -572.8 6.04 -9.5 -1.45 0
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164362 74389443 1 ClO4C13H17 AB4C13D17 -166.08 2.91 -9.51 -0.12 0
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164363 74389679 1 IO3C8H15 AB3C8D15 -116.11 4.36 -9.55 -0.82 0
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164364 74389877 4 O4C7H12 A4B7C12 -720.95 8.38 -9.26 0.09 0
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164365 74390146 2 FON2C11H12 ABC2D11E12 -77.6 5.56 -8.97 -0.36 0
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164366 74390869 1 O7C8H12 A7B8C12 -288.99 0.99 -10.36 0.03 1
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164367 74390898 1 S2O7N9C23H24 A2B7C9D23E24 -88.76 6.25 0.0 0.0 1
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164368 74390899 1 S2O7N10C22H23 A2B7C10D22E23 -62.13 10.19 0.0 0.0 1
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164369 74390900 1 S2O7N9C22H22 A2B7C9D22E22 -95.84 9.57 0.0 0.0 3
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164371 74391236 1 ON6C20H24 AB6C20D24 61.21 2.6 -8.87 -0.22 0
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164372 74391647 1 S2N7O8C38H47 A2B7C8D38E47 -213.97 5.73 -8.95 -1.3 0
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164373 74391693 1 N5O6C20H37 A5B6C20D37 -314.27 3.05 -9.98 0.19 0