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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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96240 50019472 1 O5N6C35H50 A5B6C35D50 -227.64 5.73 -8.63 -0.62 0
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96241 50019473 1 O5N6C32H44 A5B6C32D44 -201.75 6.87 -8.9 -0.33 0
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96242 50019476 1 O5N6C37H52 A5B6C37D52 -223.97 7.71 -8.9 -0.8 0
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96243 50019481 1 ClO5N6C37H51 AB5C6D37E51 -225.67 2.98 -9.2 -0.53 0
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96244 50019484 1 ClO5N6C35H47 AB5C6D35E47 -214.4 8.11 -9.0 -0.56 0
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96245 50019485 1 ClO5N6C36H49 AB5C6D36E49 -226.59 9.19 -9.0 -0.42 0
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96246 50019486 1 ClO5N6C37H51 AB5C6D37E51 -229.14 10.6 -8.85 -0.7 0
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96247 50019487 1 ClN6O6C35H47 AB6C6D35E47 -254.7 7.41 -9.07 -0.54 0
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96248 50019488 1 ClO5N6C36H49 AB5C6D36E49 -228.25 5.81 -8.96 -0.84 0
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96249 50019489 1 ClO5N6C37H51 AB5C6D37E51 -235.33 10.58 -8.79 -0.7 0
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96250 50019490 1 ClO5N6C35H49 AB5C6D35E49 -229.06 7.19 -8.97 -0.9 0
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96251 50019494 1 ClO5N6C33H45 AB5C6D33E45 -214.67 5.28 -8.91 -0.91 0
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96252 50019495 1 ClO5N6C36H49 AB5C6D36E49 -221.55 8.56 -8.83 -0.53 0
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96253 50019496 1 ClO5N6C33H45 AB5C6D33E45 -213.89 5.41 -8.91 -0.82 0
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96254 50019498 1 ClO5N6C34H45 AB5C6D34E45 -207.02 10.99 -8.81 -1.01 0
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96255 50019500 1 ClO5N6C36H49 AB5C6D36E49 -223.82 10.55 -8.83 -0.46 0
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96256 50019501 1 ClN6O6C34H45 AB6C6D34E45 -243.71 4.73 -8.91 -0.75 0
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96257 50019504 1 ClO5N6C34H47 AB5C6D34E47 -222.06 10.09 -8.88 -0.86 0
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96258 50019505 1 FO5N6C36H43 AB5C6D36E43 -219.76 6.9 -8.8 -0.5 0
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96259 50019506 1 FO5N6C36H43 AB5C6D36E43 -218.91 6.07 -8.74 -0.89 0
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96260 50019507 1 N6O6C37H46 A6B6C37D46 -212.34 8.79 -8.88 -0.85 0
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96261 50019514 1 O5N6C34H48 A5B6C34D48 -216.29 13.67 -8.91 -0.28 0
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96262 50019516 1 O5N6C36H50 A5B6C36D50 -221.9 10.96 -8.72 -0.2 0
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96263 50019521 1 FO5N6C37H45 AB5C6D37E45 -228.38 5.83 -8.98 -0.33 0
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96264 50019523 1 FO5N6C37H45 AB5C6D37E45 -220.67 5.89 -8.74 -0.81 0