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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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178311 76310165 1 ClFO3N4C33H44 ABC3D4E33F44 -180.0 6.8 -8.72 -0.42 0
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178312 76310166 2 NOC9H11 ABC9D11 -71.13 9.24 -8.1 -1.04 0
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178315 76310169 2 O3C5H5 A3B5C5 -230.4 3.11 -9.39 -1.13 0
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178316 76310170 1 O6C21H26 A6B21C26 -205.74 2.69 -8.25 -0.21 0
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178317 76310171 2 O3C11H13 A3B11C13 -186.81 3.62 -8.31 -0.03 0
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178318 76310172 2 O3C11H13 A3B11C13 -185.64 2.54 -8.1 -0.12 0
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178321 76310175 1 O43N44C164H268 A43B44C164D268 -1900.12 43.59 -6.06 -2.94 0
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178327 76310596 1 Cl2N3O3H27C32 A2B3C3D27E32 -15.08 4.05 -9.18 -0.98 0
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178328 76310613 1 ClSO2F3N3H11C18 ABC2D3E3F11G18 -128.93 6.08 -9.62 -1.66 0
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178329 76310614 1 ClO2F3N4H12C18 AB2C3D4E12F18 -121.99 8.77 -9.42 -1.42 0
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178330 76310717 1 ClN4O4H17C21 AB4C4D17E21 -26.33 3.75 -9.29 -1.66 0
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178332 76311112 1 O2N3C24H35 A2B3C24D35 -78.91 7.81 -8.9 -0.06 0
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178333 76311460 1 ClPSN3O4C19H19 ABCD3E4F19G19 -128.84 8.99 -8.35 -1.5 0
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178334 76311461 1 P2N3O8C23H29 A2B3C8D23E29 -352.86 11.57 -8.36 -1.58 0
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178335 76311636 1 N3O3H21C22 A3B3C21D22 18.44 3.66 -8.14 -1.56 0
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178336 76311655 1 N2O6C33H46 A2B6C33D46 -269.91 10.31 -9.16 -0.41 0
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178337 76311656 1 N3O4C33H47 A3B4C33D47 -189.57 9.2 -8.58 -0.3 0
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178338 76311971 1 S2N5C15H15 A2B5C15D15 137.85 7.05 -8.71 -0.9 0
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178339 76312044 1 F2O2S2N4H20C21 A2B2C2D4E20F21 -115.53 1.3 -9.02 -1.22 0
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178340 76312584 1 O2Cl3N3H10C15 A2B3C3D10E15 -15.26 1.51 -9.47 -1.29 0
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178341 76312585 1 BrO2H15C21 AB2C15D21 34.98 1.98 -9.5 -0.95 0
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178342 76312881 2 SO2N3C13H14 AB2C3D13E14 -71.74 9.85 -8.04 -0.57 0
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178343 76313659 1 ClOS2F3N3H19C21 ABC2D3E3F19G21 -125.28 13.26 -7.97 -1.66 0
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178344 76313908 1 ON4C20H22 AB4C20D22 25.16 4.09 -8.86 -0.58 0
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178345 76313980 1 BrINSO2C13H21 ABCDE2F13G21 -58.12 10.73 -7.45 -0.67 1
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178346 76313981 1 BrNSO2C13H21 ABCD2E13F21 -40.73 6.47 0.0 0.0 0
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178347 76313982 1 FSN2O2C13H19 ABC2D2E13F19 -111.17 5.48 -9.14 -0.15 0
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178348 76313983 1 ClO2N7C26H26 AB2C7D26E26 41.13 2.01 -8.0 -0.57 0
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178349 76313984 1 ClN5H12C16 AB5C12D16 108.61 4.13 -8.09 -0.6 0
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178350 76313985 1 ON5C19H19 AB5C19D19 68.09 6.01 -7.68 -0.16 0
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178351 76313995 2 N2O2H12C13 A2B2C12D13 -72.02 6.55 -9.06 -0.76 0
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178352 76314252 1 BrClNOH9C12 ABCDE9F12 11.86 6.44 -9.03 -0.93 0
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178353 76314253 1 NOBr3H12C13 ABC3D12E13 -5.81 4.42 -9.08 -1.11 0
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178354 76314694 6 NC4H8 AB4C8 -12.66 3.13 -8.97 0.36 0
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178355 76314695 1 ClN9C33H70 AB9C33D70 -66.0 2.52 -9.0 0.12 0
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178356 76315095 1 FN3O4H20C23 AB3C4D20E23 -84.85 2.92 -8.59 -1.54 0
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178357 76315096 1 ClS2N5H14C18 AB2C5D14E18 122.8 5.78 -7.81 -1.33 0
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178358 76315097 1 ClOS2N5H14C18 ABC2D5E14F18 93.16 6.25 -7.71 -1.31 0
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178359 76315098 1 O3N4H16C18 A3B4C16D18 43.15 4.3 -9.17 -1.79 0
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178360 76315665 1 NF2O4C24H25 AB2C4D24E25 -174.32 8.88 -8.91 -0.69 0
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178361 76315676 1 ClO5N6H9C17 AB5C6D9E17 86.99 6.04 -10.2 -2.29 0
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178362 76315759 2 NO2C11H13 AB2C11D13 -101.9 3.19 -8.82 -0.63 0
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178363 76315760 1 F2N2O3H22C24 A2B2C3D22E24 -105.81 4.05 -8.73 -0.4 0
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178364 76315761 1 F2N2O3H22C24 A2B2C3D22E24 -109.18 5.1 -8.79 -0.45 0
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178365 76315823 1 N4O9C32H42 A4B9C32D42 -380.75 5.31 -8.71 0.07 0
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178370 76317642 1 ClON2H21C23 ABC2D21E23 35.58 3.18 -8.38 -0.48 0
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178371 76317643 1 ClON2H21C23 ABC2D21E23 33.59 4.54 -8.38 -0.26 0
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178372 76317644 1 NO4C20H25 AB4C20D25 -118.08 1.8 -8.5 -0.03 0
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178373 76317645 1 NO4C24H29 AB4C24D29 -74.88 1.83 -8.53 -0.05 0
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178374 76317646 1 NO4C17H19 AB4C17D19 -111.16 2.96 -8.64 -0.16 0