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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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384214 134976541 1 P2O7C12H24 A2B7C12D24 -441.11 4.93 -10.21 0.21 0
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384215 134976542 1 NPSO4C20H40 ABCD4E20F40 -318.21 3.11 -9.5 0.12 -2
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384216 134976543 1 PS2N3O5C9H12 AB2C3D5E9F12 -226.94 7.54 -9.62 -2.64 -4
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384217 134976550 1 S2P3N5C10O10H12 A2B3C5D10E10F12 -404.92 6.14 -9.21 -2.74 0
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384218 134976552 1 PSeSiN8O11C58H71 ABCD8E11F58G71 -342.37 7.35 -8.5 -0.68 0
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384219 134976554 1 PSeSiN7O11C55H64 ABCD7E11F55G64 -354.8 8.83 -8.68 -1.2 0
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384220 134976557 1 PSeSiN7O11C52H68 ABCD7E11F52G68 -413.02 6.33 -8.84 -0.69 0
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384221 134976558 1 PSeSiN10O10C59H71 ABCD10E10F59G71 -259.53 5.29 -8.71 -0.99 0
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384222 134976559 1 PSeSiN4O12C47H59 ABCD4E12F47G59 -493.3 9.14 -8.73 -0.83 0
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384223 134976567 1 PO5C20H27 AB5C20D27 -237.1 2.91 -8.89 -0.17 0
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384224 134976568 1 PO7C22H31 AB7C22D31 -316.22 4.91 -8.28 -0.27 0
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384225 134976570 1 OPS2C15H25 ABC2D15E25 -119.6 1.43 -9.23 -0.07 0
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384227 134976581 1 N2S2O7H24C28 A2B2C7D24E28 -135.71 9.24 -8.98 -1.04 0
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384228 134976582 1 SiC15H26 AB15C26 -10.65 0.47 -9.7 1.1 0
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384229 134976585 2 OSiC8H16 ABC8D16 -137.53 1.76 -8.53 -0.28 0
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384230 134976586 1 NO4C25H39 AB4C25D39 -152.57 0.66 -9.18 0.26 0
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384231 134976587 1 SiC16H24 AB16C24 -7.22 1.18 -8.53 0.63 0
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384232 134976589 1 O7C33H60 A7B33C60 -369.37 2.75 -9.67 1.78 0
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384233 134976591 1 C13H16 A13B16 49.21 0.71 -9.26 0.68 0
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384235 134976594 4 OC5H8 AB5C8 -104.86 3.7 -8.58 0.5 0
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384236 134976596 2 O2C10H13 A2B10C13 -150.67 2.74 -8.43 -0.08 0
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384237 134976599 1 SiO3C27H44 AB3C27D44 -135.95 2.76 -8.68 0.43 0
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384238 134976601 1 NH17C18 AB17C18 80.75 2.81 -8.2 0.16 0
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384239 134976602 1 N2C7H8 A2B7C8 96.23 8.9 -8.48 -0.14 0
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384240 134976605 1 H11C14 A11B14 116.95 1.87 0.0 0.0 0
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384241 134976607 1 NH21C24 AB21C24 108.02 1.32 -8.11 -0.05 0
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384242 134976609 1 SSi2O5C38H58 AB2C5D38E58 -150.53 2.35 -7.51 -0.69 0
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384243 134976610 4 H7C8 A7B8 182.26 1.82 -8.28 -0.9 0
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384244 134976611 1 FNSH12C16 ABCD12E16 49.56 3.36 -8.91 -1.0 0
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384245 134976613 1 Si2O3C10H14 A2B3C10D14 58.74 2.89 -6.51 -1.84 0
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384246 134976614 1 O3C17H22 A3B17C22 -119.32 3.29 -9.4 -0.45 0
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384247 134976618 1 OH16C19 AB16C19 41.78 2.33 -8.88 -1.36 0
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384248 134976621 1 OK2S3C4 AB2C3D4 -41.07 4.61 -5.96 -0.35 0
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384249 134976626 1 KNC13H18 ABC13D18 40.23 7.26 -5.8 0.6 0
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384250 134976629 1 NSiC16H27 ABC16D27 -33.82 1.79 -9.13 0.11 0
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384251 134976633 1 N2O3H20C24 A2B3C20D24 13.04 7.64 -8.34 -1.02 -2
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384253 134976636 1 LiNSiC18H30 ABCD18E30 -33.95 4.09 -6.49 0.26 0
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384254 134976637 1 NSiC18H31 ABC18D31 -57.0 1.76 -8.7 0.62 0
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384255 134976638 1 LiSiC13H19 ABC13D19 5.62 6.39 -6.97 0.72 0
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384257 134976640 1 LiC17H31 AB17C31 27.81 5.67 -6.33 3.11 0
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384258 134976642 1 LiNC13H18 ABC13D18 25.49 5.5 -7.01 0.65 0
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384259 134976643 1 LiNC19H22 ABC19D22 105.02 12.85 -4.49 -0.81 0
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384260 134976644 1 NC19H23 AB19C23 21.63 2.54 -8.13 0.22 0
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384261 134976645 1 SN2O5H22C29 AB2C5D22E29 -31.11 3.37 -8.22 -0.97 0
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384262 134976646 1 NOH17C20 ABC17D20 55.51 2.59 -9.3 -0.41 0
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384264 134976650 1 SiO4C25H44 AB4C25D44 -270.63 2.54 -8.76 0.35 0
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384265 134976652 1 OH36C42 AB36C42 763.93 34.55 -5.43 -4.1 0
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384266 134976653 1 ClS3O4H23C24 AB3C4D23E24 97.59 6.86 -8.91 -4.34 0
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384267 134976655 1 O2P2H30C39 A2B2C30D39 40.52 7.02 -9.03 -0.37 0
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384268 134976656 1 OC14H26 AB14C26 -68.44 1.97 -9.99 1.64 0
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384269 134976657 1 OPC15H23 ABC15D23 -39.93 0.98 -8.16 0.28 0
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384270 134976658 1 IOPC14H22 ABCD14E22 -45.42 1.8 -8.25 -0.66 0
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384271 134976660 1 IPSeN2C23H36 ABCD2E23F36 -12.58 8.67 -8.39 -0.23 0
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384272 134976662 1 IPO2C23H24 ABC2D23E24 -46.4 5.25 -8.06 -0.43 0
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384273 134976663 1 IPO2H26C33 ABC2D26E33 38.67 6.19 -8.32 -0.62 0
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384274 134976664 1 IOPC22H24 ABCD22E24 -0.37 7.72 -7.75 -0.16 0
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384275 134976666 1 BrPO2C23H26 ABC2D23E26 -40.63 8.15 -8.57 0.06 0
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384276 134976668 1 ClNPO2H27C28 ABCD2E27F28 -32.64 4.28 -8.76 -0.18 0
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384277 134976671 1 ClPSeH20C23 ABCD20E23 70.0 5.15 -8.85 -0.13 0
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384278 134976672 1 PS2F3O3C25H26 AB2C3D3E25F26 -237.03 10.18 -8.98 -0.56 0
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384279 134976674 1 ClNPSC25H39 ABCDE25F39 -69.6 8.82 -7.79 0.44 0
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384280 134976675 1 INPSC26H41 ABCDE26F41 -22.7 4.83 -8.23 -0.12 0
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384281 134976676 1 PSO5C29H29 ABC5D29E29 -145.15 6.02 -9.38 -0.25 0
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384282 134976677 1 PSO5H33C35 ABC5D33E35 -115.05 7.59 -9.4 -0.37 0
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384283 134976678 1 PO3C23H23 AB3C23D23 -76.14 3.46 -9.38 -0.29 0
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384284 134976679 1 PO3C24H25 AB3C24D25 -89.87 3.29 -9.25 -0.2 0
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384285 134976680 1 IPO2H24C28 ABC2D24E28 -3.66 5.91 -8.34 -0.84 0
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384286 134976681 1 IPO3H26C29 ABC3D26E29 -48.09 6.03 -8.34 -0.61 0
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384287 134976682 1 BrPO2C19H24 ABC2D19E24 -48.02 5.89 -8.78 -0.12 0
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384288 134976687 1 ClNPO3H27C28 ABCD3E27F28 -60.85 3.53 -8.53 -0.18 0
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384289 134976688 1 BrPSC27H52 ABCD27E52 -114.5 4.31 -8.58 -0.01 0
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384290 134976691 1 PS2F3O3C26H28 AB2C3D3E26F28 -241.5 10.19 -8.9 -0.54 0
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384291 134976692 1 BrNPSO2H19C23 ABCDE2F19G23 61.79 14.14 -7.74 -0.8 0
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384292 134976697 1 ClOPH20C21 ABCD20E21 8.0 4.53 -9.28 -0.34 0
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384293 134976698 1 PBr2N2O2H19C21 AB2C2D2E19F21 -56.37 8.9 -8.56 -0.54 0
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384294 134976701 1 NSSiO4C23H31 ABCD4E23F31 -162.85 5.12 -8.83 -0.48 0
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384295 134976702 1 SN2O5H28C29 AB2C5D28E29 -99.89 10.6 -8.7 -0.72 0
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384296 134976703 1 BrPC26H28 ABC26D28 44.99 6.12 -8.4 -0.15 0
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384297 134976704 1 PSSiF3O4C17H38 ABCD3E4F17G38 -478.87 11.61 -9.81 0.69 0
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384298 134976706 1 NSSiO5C16H25 ABCD5E16F25 -198.33 3.07 -9.35 -0.41 0
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384299 134976707 1 NSO6C29H31 ABC6D29E31 -168.79 9.25 -8.33 -0.56 0
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384300 134976710 1 PO2F3C26H28 AB2C3D26E28 -217.46 10.82 -9.53 -0.42 0
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384302 134976714 1 O2C19H24 A2B19C24 -86.9 1.66 -8.83 -0.47 0
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384304 134976721 1 BrPC26H28 ABC26D28 48.3 6.25 -8.37 -0.11 0
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384305 134976728 1 PCl2C26H35 AB2C26D35 6.43 3.79 -8.82 -0.05 0
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384306 134976732 1 Si4N7O10C47H79 A4B7C10D47E79 -520.13 3.09 -8.75 -0.81 0
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384307 134976733 1 Si4O9C50H90 A4B9C50D90 -472.34 2.18 -8.71 0.07 0
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384308 134976737 3 N3H25C29 A3B25C29 831.3 3.74 -8.16 -0.95 0
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384310 134976740 1 KPO3H10F18C22 ABC3D10E18F22 -1131.11 13.52 -10.1 -0.88 0
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384311 134976742 1 P2O4Cl10H12C17 A2B4C10D12E17 -298.27 4.6 -9.17 -1.1 0
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384312 134976743 1 NPO6Cl8H20C34 ABC6D8E20F34 -156.64 3.18 -7.31 -1.37 0
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384313 134976748 1 NPCl8O10C26H28 ABC8D10E26F28 -546.84 19.39 -8.39 -0.38 -1
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384314 134976749 1 PCl8O10H20C24 AB8C10D20E24 -494.9 4.77 0.0 0.0 0
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384315 134976750 1 NPCl8O10C28H32 ABC8D10E28F32 -568.01 14.37 -8.73 -0.7 -1
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384316 134976751 1 PCl8O10H24C26 AB8C10D24E26 -522.39 4.72 0.0 0.0 -1
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384317 134976759 1 PBr2O6Cl8H10C26 AB2C6D8E10F26 -219.59 7.09 0.0 0.0 1
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384318 134976767 1 NPO5C13H31 ABC5D13E31 -287.43 5.72 0.0 0.0 0
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384319 134976768 1 NPO5C14H32 ABC5D14E32 -303.48 12.05 -9.38 -0.15 -2
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384320 134976771 1 PSN2O7C9H11 ABC2D7E9F11 -304.56 4.52 -10.26 -2.42 -3
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384321 134976773 1 SP2N4C10O10H11 AB2C4D10E10F11 -389.39 10.9 0.0 0.0 -3