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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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165492 74557843 1 ClFON4C20H23 ABCD4E20F23 11.18 5.13 0.0 0.0 1
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165493 74557844 1 FON4C20H24 ABC4D20E24 18.57 5.45 0.0 0.0 1
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165494 74558304 1 ON2C19H33 AB2C19D33 -40.55 0.64 0.0 0.0 1
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165495 74558450 1 N2O3C14H23 A2B3C14D23 -67.8 5.41 0.0 0.0 -2
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165496 74558763 1 FNSO5H18C21 ABCD5E18F21 -28.67 22.75 -7.54 -5.43 1
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165497 74558944 1 O2N3C15H24 A2B3C15D24 27.66 7.59 0.0 0.0 1
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165498 74558945 1 O2N3C18H28 A2B3C18D28 20.05 6.19 0.0 0.0 -1
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165499 74558946 1 BrClN3O3C13H14 ABC3D3E13F14 -47.74 3.29 0.0 0.0 -1
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165500 74558947 1 N3O4C14H16 A3B4C14D16 -51.77 3.23 0.0 0.0 1
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165501 74558948 1 O2N3C18H26 A2B3C18D26 37.59 14.35 0.0 0.0 -2
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165502 74558949 1 N2O8H18C27 A2B8C18D27 -116.85 9.28 -9.31 -1.92 1
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165503 74558967 1 O2N3C26H38 A2B3C26D38 7.72 5.46 0.0 0.0 1
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165504 74558968 1 N2O2C16H25 A2B2C16D25 -30.28 1.84 0.0 0.0 0
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165505 74559104 1 FSN2O4C17H23 ABC2D4E17F23 -201.78 14.0 -9.34 -0.06 1
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165506 74559276 1 ClON4C20H34 ABC4D20E34 -4.19 6.09 0.0 0.0 -1
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165507 74559534 1 SN2O7H15C19 AB2C7D15E19 -155.93 8.93 0.0 0.0 -1
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165508 74559535 1 BrSN2O4H12C17 ABC2D4E12F17 -135.42 3.24 0.0 0.0 1
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165509 74559536 1 NO2C17H22 AB2C17D22 -15.28 2.94 0.0 0.0 1
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165510 74559725 1 O4N5C23H28 A4B5C23D28 -45.14 10.21 0.0 0.0 1
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165511 74559726 1 BrO4N5C23H27 AB4C5D23E27 -45.57 11.08 0.0 0.0 1
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165512 74559773 1 N3O4C22H32 A3B4C22D32 -95.9 7.45 0.0 0.0 -2
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165513 74560073 1 SN2O5H14C20 AB2C5D14E20 0.12 6.12 -9.15 -2.49 1
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165514 74560101 1 ON3C20H28 AB3C20D28 28.62 3.89 0.0 0.0 -2
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165515 74560342 1 FNO5H16C21 ABC5D16E21 -145.44 5.56 -9.85 -1.03 -1
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165516 74560374 1 Cl2N2O4C19H21 A2B2C4D19E21 -116.03 1.61 0.0 0.0 0
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165517 74560407 1 NO2C7H11 AB2C7D11 -90.08 4.57 -10.22 0.54 0
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165518 74560516 1 O2N4C15H18 A2B4C15D18 -2.03 9.54 -9.06 -2.11 0
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165519 74560517 1 O2N3H13C16 A2B3C13D16 37.47 7.99 -9.16 -1.94 0
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165520 74560758 1 N2O5C28H34 A2B5C28D34 -122.22 19.7 -7.99 -0.18 1
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165521 74560794 1 OCl2N3C20H26 AB2C3D20E26 5.78 6.75 0.0 0.0 0
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165522 74561231 1 O2S2N3C16H21 A2B2C3D16E21 -55.93 2.4 -8.64 -1.03 -2
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165523 74561232 1 SF3N3O4H10C20 AB3C3D4E10F20 -159.45 15.88 -8.86 -2.34 0
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165524 74561233 1 O2N7C30H35 A2B7C30D35 78.61 11.46 -8.28 -1.58 1
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165525 74561234 1 ON7C26H30 AB7C26D30 115.73 12.37 0.0 0.0 0
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165526 74561235 1 ON7C26H29 AB7C26D29 218.63 11.95 -6.88 -2.47 0
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165527 74561236 1 FO2N7C28H40 AB2C7D28E40 -67.84 2.9 -8.21 -0.1 0
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165528 74561237 1 O3N7C29H33 A3B7C29D33 45.51 9.8 -8.19 -1.61 0
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165529 74561501 1 N3O4C13H17 A3B4C13D17 -110.45 8.5 -10.27 -1.88 1
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165530 74561502 1 N3O4C13H18 A3B4C13D18 -99.05 6.53 0.0 0.0 1
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165531 74561530 1 NO3C17H28 AB3C17D28 -101.18 2.17 0.0 0.0 1
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165532 74561601 1 ON4C28H31 AB4C28D31 51.68 6.79 0.0 0.0 1
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165533 74561730 1 SN2C10H15 AB2C10D15 48.35 2.56 0.0 0.0 1
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165534 74561905 1 NC12H20 AB12C20 -2.19 2.27 0.0 0.0 0
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165535 74562121 1 O5N6C27H34 A5B6C27D34 -88.7 7.27 -9.57 -0.18 -1
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165536 74562192 1 N3O5C24H26 A3B5C24D26 -89.56 10.44 0.0 0.0 1
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165537 74562519 1 ClON5C19H23 ABC5D19E23 26.52 6.78 0.0 0.0 1
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165538 74562590 1 N4O5C26H27 A4B5C26D27 -64.94 5.08 0.0 0.0 -1
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165539 74562591 1 N3O5H10C14 A3B5C10D14 8.01 3.48 0.0 0.0 -1
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165540 74562592 1 N3O5H18C20 A3B5C18D20 -69.5 22.12 0.0 0.0 -2
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165541 74562593 1 FSN2O5H11C19 ABC2D5E11F19 -81.64 11.64 -8.51 -2.11 1