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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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178261 76306414 2 O2N3C13H19 A2B3C13D19 -154.51 6.38 -8.42 0.14 0
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178262 76306415 1 SN4O4C25H32 AB4C4D25E32 -130.38 5.33 -8.56 -0.54 1
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178263 76306416 1 O4N5C20H32 A4B5C20D32 -180.64 8.06 0.0 0.0 0
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178264 76306651 1 ON5C21H29 AB5C21D29 48.57 4.34 -8.64 0.46 1
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178265 76306668 1 N4O4H17C18 A4B4C17D18 41.07 3.73 0.0 0.0 0
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178266 76306669 1 O5N6C23H38 A5B6C23D38 -218.47 4.51 -9.5 -0.2 0
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178267 76307120 1 BrN2S2O3H15C16 AB2C2D3E15F16 -41.14 8.11 -9.15 -1.62 0
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178268 76307405 1 S2N3O7C19H27 A2B3C7D19E27 -273.76 7.86 -9.28 -1.0 0
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178269 76307406 1 FNSO6H18C19 ABCD6E18F19 -242.93 1.93 -9.49 -1.18 0
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178270 76307407 1 S2N3O6C20H21 A2B3C6D20E21 -160.59 3.72 -8.98 -0.89 0
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178271 76307505 1 N2O5C29H34 A2B5C29D34 -184.59 3.97 -9.18 -0.34 0
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178272 76307720 1 SN3O6C24H29 AB3C6D24E29 -228.41 2.9 -8.98 -0.92 0
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178273 76307721 1 ClNS2O7C17H18 ABC2D7E17F18 -270.47 5.2 -9.57 -1.27 0
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178274 76307722 1 NSCl3O6H16C17 ABC3D6E16F17 -238.58 3.71 -9.2 -0.96 0
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178275 76307723 1 NSO7H19C24 ABC7D19E24 -205.68 4.16 -9.57 -1.75 0
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178276 76307724 1 NSO6C17H19 ABC6D17E19 -218.92 4.8 -9.3 -0.78 0
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178277 76307725 1 SN2O5H18C19 AB2C5D18E19 -147.75 3.7 -9.48 -1.07 1
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178278 76307726 1 N3O7C18H22 A3B7C18D22 -248.32 6.63 0.0 0.0 1
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178279 76307727 1 O6N8C21H25 A6B8C21D25 -136.6 4.58 0.0 0.0 0
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178280 76307728 1 O5N9C21H25 A5B9C21D25 -73.36 7.41 -9.68 -1.28 0
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178281 76307729 1 N4O8C23H34 A4B8C23D34 -333.39 5.97 -8.23 -0.05 0
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178282 76307730 1 FSN3O3C18H18 ABC3D3E18F18 -81.89 6.96 -9.7 -0.94 0
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178283 76308474 1 N5O5C24H29 A5B5C24D29 -105.1 6.09 -8.11 -0.45 0
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178284 76308475 1 F3N3O4H16C21 A3B3C4D16E21 -215.27 7.3 -9.38 -1.62 0
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178285 76308476 1 SN2F3O7H23C30 AB2C3D7E23F30 -334.13 8.33 -8.68 -1.43 0