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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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234579 92303105 1 SN2O5H12C16 AB2C5D12E16 -62.38 3.67 -9.28 -1.87 0
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234580 92303108 1 SN4O4H8C13 AB4C4D8E13 33.09 4.64 -9.73 -2.04 0
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234581 92303109 3 NOSC4H5 ABCD4E5 -64.91 9.37 -8.32 -0.77 0
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234582 92303110 1 SF2O2N3H17C19 AB2C2D3E17F19 -113.62 1.86 -9.34 -1.04 0
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234583 92303113 1 N2O3C16H24 A2B3C16D24 -108.41 3.48 -9.31 -0.47 0
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234584 92303115 2 SN2C10H12 AB2C10D12 88.79 5.88 -8.56 -1.02 0
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234585 92303116 1 OSN2C24H30 ABC2D24E30 -22.89 4.2 -8.31 -0.29 0
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234586 92303118 1 O3N5C21H21 A3B5C21D21 28.46 6.4 -9.25 -1.5 0
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234587 92303120 1 O3N5C21H21 A3B5C21D21 32.3 7.76 -9.31 -1.7 0
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234588 92303121 1 O3N5C15H17 A3B5C15D17 4.27 4.97 -9.27 -1.53 0
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234589 92303122 1 NOC16H27 ABC16D27 -100.09 4.58 -9.54 1.36 0
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234590 92303126 1 N3O3C10H13 A3B3C10D13 -82.75 8.23 -10.75 -0.43 0
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234591 92303127 1 N2O4C7H10 A2B4C7D10 -172.4 3.37 -10.68 -0.48 0
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234592 92303130 1 NSO4C22H23 ABC4D22E23 -128.36 5.14 -8.43 -1.36 0
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234593 92303132 1 O3C24H34 A3B24C34 -155.54 6.05 -9.86 -0.67 0
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234594 92303133 1 NSO4C24H25 ABC4D24E25 -129.66 2.32 -8.4 -1.17 0
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234595 92303134 1 NSO4C24H25 ABC4D24E25 -79.87 4.78 -8.21 -1.76 0
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234596 92303135 1 O3C24H34 A3B24C34 -157.02 6.5 -9.87 -0.62 0
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234597 92303136 1 O3C24H34 A3B24C34 -157.34 6.61 -9.84 -0.62 1
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234598 92303139 1 ON2C29H35 AB2C29D35 15.73 3.5 0.0 0.0 0
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234599 92303140 1 N2S2O3C21H24 A2B2C3D21E24 -52.95 7.22 -8.63 -1.46 0
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234600 92303141 1 N2O2C15H26 A2B2C15D26 -127.49 1.44 -9.48 0.77 0
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234601 92303144 1 SO3N4C21H30 AB3C4D21E30 -133.96 5.4 -9.02 -1.29 0
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234602 92303148 1 O2N5C17H21 A2B5C17D21 8.05 7.06 -8.88 -1.16 0
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234603 92303151 1 O3N4C24H26 A3B4C24D26 -9.28 5.49 -8.93 -1.24 0
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234604 92303153 1 O2N5C24H27 A2B5C24D27 27.77 7.04 -8.61 -1.2 0
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234605 92303155 1 O3N4C24H26 A3B4C24D26 -8.92 6.27 -8.96 -1.31 0
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234606 92303158 1 SN2O6H18C20 AB2C6D18E20 -186.79 4.5 -8.36 -1.46 0
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234607 92303160 1 N2O4C17H24 A2B4C17D24 -171.62 5.9 -8.01 0.34 0
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234608 92303162 1 SO2N4C21H28 AB2C4D21E28 -64.5 5.33 -9.17 -1.31 0
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234609 92303163 1 N3O5C16H17 A3B5C16D17 -61.67 4.58 -9.76 -1.36 0
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234615 92303171 2 NOC8H11 ABC8D11 -71.25 4.8 -8.91 -0.29 0
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234616 92303172 2 NOC8H11 ABC8D11 -71.16 4.65 -8.95 -0.24 0
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234617 92303173 1 ON3C14H15 AB3C14D15 9.05 3.51 -8.64 -0.26 0
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234618 92303174 1 O2N5C22H27 A2B5C22D27 -37.73 6.48 -9.34 -0.55 0
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234619 92303175 1 O2N5C22H27 A2B5C22D27 -41.27 4.18 -9.2 -0.39 0
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234620 92303176 1 O2N5C22H27 A2B5C22D27 -48.45 6.09 -8.86 -0.09 0
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234621 92303182 1 N3O4C23H27 A3B4C23D27 -121.93 3.56 -8.99 -0.73 0
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234622 92303183 1 N3O4C23H27 A3B4C23D27 -121.97 4.61 -8.98 -0.75 0
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234623 92303185 1 ON5C17H17 AB5C17D17 57.55 4.02 -8.35 -0.32 0
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234624 92303186 1 ON5C17H17 AB5C17D17 57.15 3.67 -8.35 -0.32 0
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234625 92303187 1 ClO2N4C23H25 AB2C4D23E25 -3.31 3.07 -8.83 -0.75 0
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234626 92303195 1 ClO2N4C21H21 AB2C4D21E21 8.97 1.5 -8.9 -0.75 0
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234627 92303196 1 O2N5C21H25 A2B5C21D25 9.75 3.16 -8.28 -0.44 0
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234628 92303197 1 O2N5C21H25 A2B5C21D25 9.79 3.75 -8.28 -0.44 0
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234629 92303198 1 NO4C17H17 AB4C17D17 -73.06 3.12 -8.9 -0.03 0
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234630 92303200 1 NSO3H17C18 ABC3D17E18 -78.02 3.55 -9.43 -0.59 0
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234631 92303201 1 NSO3H17C18 ABC3D17E18 -80.83 7.67 -9.18 -0.55 0
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234632 92303202 1 NSO3H17C18 ABC3D17E18 -82.77 6.42 -9.2 -0.55 0
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234633 92303205 1 ON5C20H23 AB5C20D23 42.24 4.88 -8.47 -0.42 0
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234634 92303207 1 Cl2N2O3H10C12 A2B2C3D10E12 -123.93 2.61 -9.69 -0.83 0
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234635 92303209 1 N3O5H11C12 A3B5C11D12 -105.91 5.64 -10.18 -1.68 0
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234636 92303210 1 N3O5H11C12 A3B5C11D12 -105.82 5.72 -10.18 -1.69 0
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234637 92303212 1 SN2O2C14H16 AB2C2D14E16 -50.81 3.39 -9.15 -0.8 0
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234638 92303213 1 NO4C13H13 AB4C13D13 -153.41 6.44 -9.34 -1.13 0
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234639 92303214 1 NO4C13H13 AB4C13D13 -153.34 4.52 -9.17 -0.98 0
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234640 92303219 1 N2O3C13H22 A2B3C13D22 -166.85 2.24 -9.46 -0.4 0
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234641 92303226 1 O3N5C9H13 A3B5C9D13 -64.29 3.43 -9.8 -1.0 0
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234642 92303229 1 N2O5C19H30 A2B5C19D30 -205.22 7.39 -9.18 0.15 0
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234643 92303230 1 N2O5C19H30 A2B5C19D30 -204.3 4.45 -9.38 0.17 0
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234644 92303232 1 ON4C18H24 AB4C18D24 -0.15 1.76 -8.91 -0.63 0
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234645 92303233 2 NO2C11H14 AB2C11D14 -124.84 6.07 -9.3 -0.03 0
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234646 92303234 2 NO2C11H14 AB2C11D14 -125.55 5.56 -9.37 -0.09 0
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234647 92303236 1 N2O4C25H32 A2B4C25D32 -123.29 1.6 -9.05 0.38 0
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234648 92303237 1 N2O3C14H22 A2B3C14D22 -98.9 1.86 -9.47 -0.5 0
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234649 92303238 1 N2O3C14H22 A2B3C14D22 -100.55 3.09 -9.57 -0.73 0
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234650 92303239 1 N2S3O4C13H22 A2B3C4D13E22 -162.42 8.65 -8.92 -0.83 0
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234651 92303240 1 N2S3O4C13H22 A2B3C4D13E22 -163.94 7.58 -8.92 -0.28 0
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234652 92303241 1 NO2C12H17 AB2C12D17 -66.36 4.44 -9.04 -0.42 0
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234653 92303242 1 NO6C22H27 AB6C22D27 -254.27 7.2 -9.36 -0.97 0
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234654 92303244 1 NBr2O2H13C14 AB2C2D13E14 -62.06 0.32 -9.28 -0.88 0
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234655 92303246 1 SO2N3C18H27 AB2C3D18E27 -56.55 10.09 -8.35 -0.38 0
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234656 92303250 1 ON4C13H22 AB4C13D22 -8.96 3.35 -9.0 -0.06 0
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234657 92303251 1 O2N3C22H29 A2B3C22D29 -44.61 2.11 -9.1 0.11 0
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234658 92303252 1 O2N3C22H29 A2B3C22D29 -47.64 1.15 -9.03 0.14 0