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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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180199 76595493 2 SN2C19H24 AB2C19D24 147.07 9.12 -5.59 -1.41 0
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180200 76595726 1 PtF6N6H22C37 AB6C6D22E37 119.37 2.67 -9.54 -4.19 0
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180201 76595873 1 ClN2O4C17H17 AB2C4D17E17 -107.44 3.06 -10.07 -1.48 0
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180202 76595970 1 SN2O2C16H22 AB2C2D16E22 -28.88 3.32 -8.59 -1.1 0
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180203 76596128 1 NO10C34H57 AB10C34D57 -509.95 6.79 -8.19 0.02 0
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180204 76596129 1 NO10C31H53 AB10C31D53 -505.11 5.64 -8.33 0.04 0
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180206 76596273 1 MnCl2N5O8C22H41 AB2C5D8E22F41 -395.25 4.74 0.0 0.0 0
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180207 76596274 1 N5O8C22H41 A5B8C22D41 -376.75 6.73 -8.77 0.35 0
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180208 76596280 1 MnCl2N5C14H25 AB2C5D14E25 79.53 6.35 0.0 0.0 0
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180209 76596713 1 SN4O4C10H20 AB4C4D10E20 -167.09 7.24 -9.25 0.08 1
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180210 76597578 1 ClS2N7O7H21C23 AB2C7D7E21F23 -100.63 18.63 0.0 0.0 0
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180211 76597579 1 ClS2O7N8C21H21 AB2C7D8E21F21 -120.46 19.55 -8.81 -1.92 1
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180212 76597580 1 ClS2O7N8C21H22 AB2C7D8E21F22 -125.03 10.05 0.0 0.0 0
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180213 76598868 1 F3O3C33H35 A3B3C33D35 -231.0 5.17 -9.22 -0.62 0
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180214 76599575 1 SO3N6C21H28 AB3C6D21E28 -74.79 6.04 -8.77 0.02 0
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180215 76600263 1 NOC18H29 ABC18D29 -43.32 4.29 -9.2 0.94 0
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180216 76600389 1 O8N12C43H60 A8B12C43D60 -250.76 4.73 -8.35 0.06 0
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180217 76600661 1 ClSN2O4C11H11 ABC2D4E11F11 -135.79 5.16 -9.54 -1.38 0
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180218 76600662 1 SN4O5H18C22 AB4C5D18E22 -46.29 7.68 -8.89 -1.79 0
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180219 76600663 1 SN2O4H16C17 AB2C4D16E17 -106.72 3.13 -9.3 -1.01 0
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180220 76600706 1 ClORhN2C22H26 ABCD2E22F26 -16.25 34.05 -9.0 -3.61 0
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180221 76601515 1 SCl3N4O12C39H43 AB3C4D12E39F43 -371.72 5.99 -8.72 -1.08 -2
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180222 76601824 1 YN3O6C25H39 AB3C6D25E39 -264.98 10.35 0.0 0.0 0
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180223 76601941 1 O3N4C10H16 A3B4C10D16 -94.05 3.67 -10.38 -0.34 0
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180224 76601982 1 ClFON6C18H20 ABCD6E18F20 -24.74 3.54 -9.14 -1.13 0
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180225 76602010 1 FSN5O5C41H56 ABC5D5E41F56 -288.06 4.31 -8.96 -0.46 0
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180226 76602011 1 SN4O5C35H44 AB4C5D35E44 -202.05 5.78 -8.68 -0.17 0
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180227 76602012 1 SF2N3O3C25H37 AB2C3D3E25F37 -242.43 2.69 -8.49 -0.95 0
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180228 76602013 1 SN5O5C41H57 AB5C5D41E57 -247.2 6.23 -8.89 -0.36 0
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180229 76602236 1 O3C8H14 A3B8C14 -147.15 3.22 -10.33 0.5 0
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180230 76602302 1 N2S3O6C24H28 A2B3C6D24E28 -176.54 4.66 -8.42 -1.0 0
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180231 76602335 1 N2S2O6C23H24 A2B2C6D23E24 -161.42 2.96 -9.32 -1.26 0
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180232 76602342 1 N2S2O3F5H21C26 A2B2C3D5E21F26 -234.52 7.59 -8.83 -0.78 0
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180233 76602343 1 SN2O7C46H68 AB2C7D46E68 -293.88 6.0 -9.06 -0.73 -1
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180234 76602461 1 ReN9O10C51H62 AB9C10D51E62 -103.58 8.28 -7.8 -1.66 0
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180235 76602517 1 BN3O3C15H24 AB3C3D15E24 -73.69 3.58 -8.64 -0.05 0
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180236 76602605 1 SN5O8C38H43 AB5C8D38E43 -181.12 11.53 -8.63 -0.91 0
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180237 76602759 1 ClO4N6H35C40 AB4C6D35E40 10.56 4.09 -8.8 -0.78 0
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180238 76602988 1 ClNO6C27H28 ABC6D27E28 -185.48 1.37 -8.86 -0.7 0
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180239 76602989 1 ClN4O6C30H33 AB4C6D30E33 -136.22 2.04 -8.99 -0.82 0
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180240 76602990 1 ClO4N5C28H30 AB4C5D28E30 -35.86 4.04 -9.0 -0.62 0
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180241 76603064 1 ClSN5O5C27H28 ABC5D5E27F28 -63.45 4.69 -8.97 -0.94 0
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180242 76603279 1 ClN4O5C28H29 AB4C5D28E29 -92.12 3.09 -8.86 -0.86 0
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180243 76603395 1 ClN3O5C29H30 AB3C5D29E30 -111.17 2.88 -8.85 -0.88 0
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180244 76604109 1 SN4O6C25H40 AB4C6D25E40 -296.81 6.84 -9.35 -0.47 0
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180245 76604114 4 NC9H14 AB9C14 -28.26 1.04 -8.17 1.24 0
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180246 76604115 1 O3F4N5C18H19 A3B4C5D18E19 -260.8 2.43 -9.72 -0.22 0
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180247 76604116 1 FO4N5C16H18 AB4C5D16E18 -73.69 5.15 -9.64 -0.53 0
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180248 76604117 1 FO2N5C16H20 AB2C5D16E20 -65.5 4.12 -9.41 -0.23 0
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180249 76604287 1 FNO2S2H24C25 ABC2D2E24F25 -49.54 10.36 -8.45 -0.43 0