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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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190069 77950116 1 OSN4C8H12 ABC4D8E12 -1.16 4.73 -9.26 -1.0 0
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190070 77950117 1 N3O3C23H27 A3B3C23D27 -59.73 5.58 -8.57 -0.43 0
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190071 77950118 1 O3N4C29H38 A3B4C29D38 -84.93 2.42 -8.86 -0.88 0
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190072 77950119 2 ON2C13H15 AB2C13D15 -7.57 3.54 -8.32 -1.05 0
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190073 77950120 1 ON4C19H22 AB4C19D22 25.17 6.11 -8.05 -0.59 0
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190074 77950121 1 NO6C26H31 AB6C26D31 -184.25 4.06 -8.71 -0.5 0
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190075 77950122 1 O2H14C15 A2B14C15 -31.46 0.34 -9.46 -1.66 0
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190076 77950684 1 O3N5C30H39 A3B5C30D39 -114.71 5.11 -8.46 -0.68 0
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190077 77950685 1 O3N4C32H38 A3B4C32D38 -72.55 6.68 -8.69 -0.27 0
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190078 77950686 1 O3N6C36H46 A3B6C36D46 -64.94 8.46 -8.07 -0.23 0
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190079 77950958 1 O2N5C20H29 A2B5C20D29 -32.28 5.1 -8.65 0.4 0
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190080 77951006 1 FN3O4C27H30 AB3C4D27E30 -174.58 5.05 -9.19 -0.88 0
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190081 77951248 1 BrO4H11C12 AB4C11D12 -101.65 4.36 -9.75 -1.1 0
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190082 77951299 1 ClO2N3H18C21 AB2C3D18E21 31.69 3.15 -10.1 -1.44 0
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190083 77951459 1 SO2N4C26H42 AB2C4D26E42 -79.22 4.19 -8.8 -0.51 0
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190084 77951475 1 OSN2C18H22 ABC2D18E22 -8.0 4.32 -9.07 -0.82 0
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190085 77951476 1 ClO2N3C23H26 AB2C3D23E26 -15.8 2.7 -8.96 -0.6 0
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190086 77951679 1 O2C23H32 A2B23C32 -24.6 6.99 -7.49 -0.18 1
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190087 77952161 1 O3N4C19H25 A3B4C19D25 -73.67 2.82 0.0 0.0 0
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190088 77952168 1 N4O7C37H44 A4B7C37D44 -270.01 11.67 -9.05 -1.37 0
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190089 77952532 1 ClN3O3C21H24 AB3C3D21E24 -109.2 5.76 -9.35 -0.75 0
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190090 77952533 1 ClN3O3C22H28 AB3C3D22E28 -94.38 8.92 -9.03 -1.07 0
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190091 77952534 1 O2F3N3C25H32 A2B3C3D25E32 -229.68 9.45 -8.95 -0.89 0
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190092 77952564 1 ClO2N3C22H30 AB2C3D22E30 -76.01 7.93 -8.72 -0.66 0
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190093 77952565 1 ClO2N3C17H20 AB2C3D17E20 -60.01 6.17 -8.72 -0.82 0
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190094 77952812 1 PN7O8C23H28 AB7C8D23E28 -279.44 2.53 -8.9 -0.34 0
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190095 77952813 2 O2N3C7H9 A2B3C7D9 -84.14 3.5 -8.9 -0.34 0
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190096 77952814 1 F2O3N5C31H41 A2B3C5D31E41 -183.74 4.02 -8.34 -0.74 0
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190097 77953057 1 PN6O7C19H25 AB6C7D19E25 -255.76 5.24 -9.68 -0.43 0
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190098 77953864 1 ON2C17H28 AB2C17D28 -60.2 3.41 -9.27 1.06 0
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190099 77954016 1 N5O5C13H19 A5B5C13D19 -138.97 8.49 -9.81 -1.23 0
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190100 77954169 1 N2O6C23H26 A2B6C23D26 -220.27 7.85 -8.52 -0.35 0
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190101 77954489 1 N5O6C27H39 A5B6C27D39 -211.87 4.01 -8.55 -0.29 0
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190102 77954490 1 N5O5C24H33 A5B5C24D33 -149.03 2.58 -8.23 -0.08 0
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190103 77954491 1 SO2N6C23H24 AB2C6D23E24 8.75 5.9 -8.82 -1.1 0
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190104 77954492 1 SN4O5C26H28 AB4C5D26E28 -120.64 4.59 -8.99 -1.0 0
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190105 77954517 1 OS2N6C23H28 AB2C6D23E28 57.23 0.46 -9.01 -0.83 0
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190106 77954518 1 SO2N6C26H34 AB2C6D26E34 6.92 3.03 -9.02 -0.78 0
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190107 77954566 1 SF3O4N6C27H31 AB3C4D6E27F31 -266.28 5.86 -8.22 -0.56 0
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190108 77954567 1 SO3N7C22H29 AB3C7D22E29 -54.99 6.69 -9.2 -1.03 0
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190109 77954633 1 BrClSN2O5C30H32 ABCD2E5F30G32 -133.39 3.15 -9.26 -0.49 0
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190110 77954755 1 ClSN5O8H42C44 ABC5D8E42F44 -251.29 7.11 -8.9 -0.72 0
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190111 77955026 1 F2N3O4C29H41 A2B3C4D29E41 -281.56 5.39 -9.46 -0.7 0
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190112 77955215 1 N2C17H26 A2B17C26 18.08 2.05 -8.56 0.33 0
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190113 77955741 1 O4N6C21H30 A4B6C21D30 -126.43 2.72 -8.88 -0.21 0
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190114 77955803 1 O2C21H28 A2B21C28 -101.58 2.7 -8.64 0.28 0
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190115 77956128 2 N2O3C4H8 A2B3C4D8 -265.6 4.25 -10.16 -0.24 0
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190116 77956201 1 ClFN3O3H27C28 ABC3D3E27F28 -103.27 5.94 -8.75 -1.61 0
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190117 77956889 1 F2N3O3C24H27 A2B3C3D24E27 -183.13 4.44 -9.0 -0.4 0
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190118 77957065 1 FO4N6C24H29 AB4C6D24E29 -128.7 5.27 -8.85 -0.84 0