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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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228189 87563632 1 F3O5N15C48H54 A3B5C15D48E54 -207.16 9.02 -8.71 -1.67 0
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228190 87563635 1 PN2O3C8H19 AB2C3D8E19 -176.47 2.88 -8.59 0.63 1
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228191 87563636 1 Cl2O2F3N3C33H35 A2B2C3D3E33F35 -162.17 7.52 0.0 0.0 0
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228192 87563637 1 OSN5C11H15 ABC5D11E15 25.1 5.95 -8.7 -1.04 0
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228193 87563638 1 SN3O3H15C16 AB3C3D15E16 -69.86 4.89 -8.98 -1.25 0
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228194 87563639 1 OSN3C15H15 ABC3D15E15 15.21 10.8 -8.16 -0.51 0
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228195 87563640 1 O4N5C25H29 A4B5C25D29 -41.37 3.19 -8.38 -1.06 0
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228196 87563641 1 S2N4O8H52C57 A2B4C8D52E57 -165.98 7.59 -8.06 -0.92 0
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228197 87563645 1 BrNO3H12C13 ABC3D12E13 -95.21 5.54 -9.68 -1.57 0
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228198 87563646 1 BrON3C13H14 ABC3D13E14 11.12 2.99 -8.58 -0.4 0
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228199 87563647 1 BrON3H10C12 ABC3D10E12 62.08 4.91 -9.8 -1.18 0
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228200 87563650 1 FO4N11C64H82 AB4C11D64E82 -104.71 3.98 -9.03 -0.7 0
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228201 87563651 1 FO4N11C64H82 AB4C11D64E82 -107.3 4.48 -8.83 -0.74 0
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228202 87563652 1 N3O3H11C15 A3B3C11D15 -6.05 4.18 -8.05 -1.22 0
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228203 87563658 1 FN3O3H18C19 AB3C3D18E19 -54.62 5.48 -8.36 -0.9 0
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228204 87563661 1 NSO4C6H7 ABC4D6E7 -134.7 5.05 -10.77 -1.28 0
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228205 87563662 1 OSN3H9C10 ABC3D9E10 41.6 4.04 -8.78 -0.86 0
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228206 87563663 1 O2N5F6H21C24 A2B5C6D21E24 -311.82 8.08 -8.98 -1.2 0
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228207 87563664 1 ON5F6H23C24 AB5C6D23E24 -274.12 3.77 -8.74 -0.98 0
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228208 87563667 1 BrNO3C7H12 ABC3D7E12 -154.29 4.64 -10.36 -1.14 0
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228209 87563668 1 BrNO3C7H12 ABC3D7E12 -145.65 3.99 -10.03 -0.48 0
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228210 87563671 3 OC6H6 AB6C6 -61.37 3.78 -9.41 -0.69 0
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228211 87563672 1 SO2Cl3N3H12C15 AB2C3D3E12F15 -72.69 5.4 -9.41 -1.69 0
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228212 87563674 1 SCl3N3O3H12C15 AB3C3D3E12F15 -107.08 1.67 -9.81 -1.67 0
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228213 87563676 1 OSCl3N3H12C14 ABC3D3E12F14 -23.13 5.08 -8.53 -1.26 0
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228214 87563679 1 SCl4O4N8C63H76 AB4C4D8E63F76 -115.47 7.77 -8.57 -1.12 0
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228215 87563680 1 SCl4O4N8C63H76 AB4C4D8E63F76 -100.67 8.62 -8.49 -1.05 0
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228216 87563681 1 NSO4H5C6 ABC4D5E6 -110.88 5.78 -10.63 -1.77 0
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228217 87563682 1 S2F3O3H7C13 A2B3C3D7E13 -212.51 2.85 -8.57 -1.66 0
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228218 87563683 1 O2F3N6H23C28 A2B3C6D23E28 -99.69 4.24 -9.3 -1.32 0
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228219 87563684 1 BrNOH10C11 ABCD10E11 19.38 3.2 -9.79 -0.58 0
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228220 87563685 1 S2F3N3O5H18C25 A2B3C3D5E18F25 -246.99 2.34 -8.69 -1.72 0
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228221 87563689 1 OSN2C9H20 ABC2D9E20 -46.85 3.67 -8.65 -0.19 0
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228222 87563690 1 BrNO3H12C14 ABC3D12E14 -77.21 1.69 -9.22 -1.14 0
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228223 87563693 1 SO2N4C17H18 AB2C4D17E18 -17.44 8.07 -8.41 -0.96 0
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228224 87563695 1 ClSO3N4C17H19 ABC3D4E17F19 -94.59 10.82 -8.87 -1.37 0
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228225 87563697 1 ClOSN4C16H19 ABCD4E16F19 -13.1 11.77 -8.15 -0.57 0
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228226 87563698 1 OSN4C16H18 ABC4D16E18 22.76 11.71 -8.05 -0.31 0
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228227 87563699 1 ClSO2N4H13C15 ABC2D4E13F15 10.16 8.06 -8.97 -1.11 0
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228228 87563700 1 SSiN2O4C26H54 ABC2D4E26F54 -285.34 3.01 -8.49 0.29 0
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228229 87563701 2 NOC4H4 ABC4D4 35.2 5.32 -10.28 -1.55 0
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228230 87563705 2 PC17H17 AB17C17 90.58 2.69 -8.32 0.02 0
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228231 87563706 1 BrNSO3H10C12 ABCD3E10F12 -58.35 2.77 -8.95 -1.19 0
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228232 87563707 1 O7N8H32C37 A7B8C32D37 -56.23 9.12 -8.73 -1.76 0
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228233 87563710 1 BrClSN3O3H15C16 ABCD3E3F15G16 -99.48 5.69 -9.48 -1.54 0
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228234 87563715 1 ClSN3O4C16H16 ABC3D4E16F16 -138.71 2.83 -9.3 -1.27 0
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228235 87563716 1 SN3O4H15C16 AB3C4D15E16 -100.98 8.78 -9.48 -1.34 0
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228236 87563717 1 ClON3C13H14 ABC3D13E14 7.16 4.87 -9.22 -1.04 0
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228237 87563718 1 ClSO2N3C15H16 ABC2D3E15F16 -47.0 5.54 -8.1 -0.46 0
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228238 87563720 1 SF3N3O5C14H14 AB3C3D5E14F14 -297.53 1.38 -9.17 -1.86 0