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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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93256 49992759 1 O5N6C40H56 A5B6C40D56 -239.76 5.48 -8.64 -0.36 0
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93257 49992762 1 O5N6C37H52 A5B6C37D52 -228.68 8.14 -8.71 -0.51 0
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93258 49992765 1 F2O5N6C39H46 A2B5C6D39E46 -274.34 8.6 -8.74 -1.03 0
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93259 49992771 1 O5N6C38H52 A5B6C38D52 -234.78 7.33 -8.88 -0.87 0
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93260 49992772 1 O5N6C39H54 A5B6C39D54 -239.41 7.02 -8.72 -0.6 0
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93261 49992773 1 O5N6C40H56 A5B6C40D56 -238.87 5.19 -9.0 -0.49 0
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93262 49992774 1 O5N6C37H52 A5B6C37D52 -233.4 9.45 -8.8 -0.57 0
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93263 49992775 1 O5N6C34H46 A5B6C34D46 -213.55 10.88 -8.87 -0.79 0
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93264 49992787 1 ClO5N6C42H51 AB5C6D42E51 -199.4 3.75 -8.51 -0.63 0
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93265 49992800 1 O5N6C33H44 A5B6C33D44 -210.47 4.19 -8.98 -0.58 0
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93266 49992828 1 O5N6C37H52 A5B6C37D52 -233.73 8.3 -8.85 -0.51 0
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93267 49992831 1 O5N6C39H54 A5B6C39D54 -235.53 9.75 -8.75 -0.52 0
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93268 49992847 1 ClN6O6C37H49 AB6C6D37E49 -258.47 11.05 -9.18 -0.78 0
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93269 49992848 1 ClO5N6C38H51 AB5C6D38E51 -233.12 10.54 -8.99 -0.69 0
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93270 49992853 2 N3O3C21H26 A3B3C21D26 -222.44 2.02 -8.52 -0.62 0
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93271 49992855 1 O5N6C38H52 A5B6C38D52 -237.8 5.88 -8.69 -0.1 0
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93272 49992870 1 FO5N6C39H47 AB5C6D39E47 -231.53 12.01 -8.93 -0.82 0
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93273 49992877 1 ClO5N6C40H49 AB5C6D40E49 -211.26 16.52 -8.36 -0.7 0
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93274 49992881 2 N3O3C20H28 A3B3C20D28 -265.84 5.28 -8.86 -0.3 0
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93275 49992882 1 N6O6C37H52 A6B6C37D52 -265.91 8.61 -8.81 -0.28 0
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93276 49992895 1 N6O6C37H50 A6B6C37D50 -260.15 6.49 -8.13 -0.36 0
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93277 49992898 1 FO5N6C40H49 AB5C6D40E49 -234.28 9.86 -8.9 -0.39 0
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93278 49992909 1 FO5N6C39H47 AB5C6D39E47 -235.33 9.48 -8.86 -0.54 0
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93279 49992911 1 O5N6C34H46 A5B6C34D46 -225.19 7.88 -9.08 -0.36 0
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93280 49992912 1 O5N6C36H50 A5B6C36D50 -221.71 6.87 -9.05 -0.2 0