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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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315942 126629471 1 NO8C13H19 AB8C13D19 -345.7 3.6 -10.39 -0.64 0
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315943 126629472 1 ON4C25H26 AB4C25D26 97.56 4.2 -9.08 -0.54 0
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315945 126629474 1 N2O5C23H32 A2B5C23D32 -195.38 6.05 -9.13 0.0 0
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315946 126629475 2 NO4H12C13 AB4C12D13 -267.41 2.97 -9.53 -1.69 0
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315947 126629476 1 ON4C27H32 AB4C27D32 64.48 4.98 -8.8 -0.32 0
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315948 126629477 1 N2O6C29H38 A2B6C29D38 -225.57 5.31 -9.26 -0.91 0
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315949 126629478 1 N2O5C27H36 A2B5C27D36 -192.62 2.96 -9.17 -0.96 0
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315950 126629479 1 N2O5C30H34 A2B5C30D34 -151.38 4.16 -9.18 -0.97 0
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315951 126629480 1 BrOSN2C18H23 ABCD2E18F23 -0.62 2.76 -8.78 -1.0 0
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315952 126629481 1 N2F3O6C33H37 A2B3C6D33E37 -364.98 4.99 -9.25 -1.06 0
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315953 126629482 1 N2O7C30H40 A2B7C30D40 -273.05 4.9 -9.21 -0.94 0
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315954 126629483 1 N2O8C35H42 A2B8C35D42 -266.36 9.08 -9.38 -0.95 0
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315955 126629484 1 N2O7C35H42 A2B7C35D42 -242.8 3.21 -9.32 -0.73 0
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315959 126629490 1 N4O6C31H42 A4B6C31D42 -230.05 8.8 -8.75 -0.58 0
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315961 126629492 1 ClON2C8H15 ABC2D8E15 -73.91 4.08 -9.24 -0.24 0
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315962 126629493 1 BrN3C18H24 AB3C18D24 40.21 5.09 -9.02 -0.13 0
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315963 126629495 1 OC9H12 AB9C12 -24.55 2.16 -8.18 0.41 0
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315964 126629498 1 SO6C12H24 AB6C12D24 -314.31 3.99 -10.32 -0.08 0
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315965 126629503 1 ON2H30C49 AB2C30D49 200.02 3.63 -8.04 -0.57 0
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315966 126629505 1 NH35C47 AB35C47 171.66 1.38 -8.13 -0.56 0
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315968 126629508 1 FN5O5C30H38 AB5C5D30E38 -184.56 6.2 -9.16 -1.18 0
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315969 126629511 1 N2H38C61 A2B38C61 276.65 0.61 -8.11 -0.62 0
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315971 126629513 1 N3H43C67 A3B43C67 315.48 1.61 -7.75 -0.66 0
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315972 126629517 1 ON3H37C61 AB3C37D61 459.66 3.34 -7.83 -0.72 0
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315973 126629518 1 N2H38C61 A2B38C61 461.19 1.43 -7.99 -1.12 0
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315974 126629520 1 N3H41C67 A3B41C67 315.32 1.54 -8.06 -0.56 0
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315975 126629525 1 N2H46C67 A2B46C67 257.16 0.44 -7.94 -0.57 0
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315976 126629527 1 O2N3H43C73 A2B3C43D73 285.23 3.94 -7.77 -0.76 0
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315977 126629538 1 OS2N4C16H20 AB2C4D16E20 59.07 5.67 -7.67 -0.46 0
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315978 126629539 1 NC8H13 AB8C13 29.45 2.4 -9.19 -0.1 0
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315979 126629542 1 N4O7C37H54 A4B7C37D54 -302.36 7.58 -9.12 -0.62 0
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315980 126629543 1 ClN2F3H6C8 AB2C3D6E8 -71.13 3.74 -10.45 -1.4 1
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315983 126629551 1 N2O7C26H49 A2B7C26D49 -349.42 9.62 0.0 0.0 1
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315984 126629552 1 SN7O13C42H76 AB7C13D42E76 -558.0 13.94 0.0 0.0 0
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315985 126629559 1 N7O7C28H33 A7B7C28D33 -232.53 13.41 -8.91 -1.53 0
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315988 126629568 1 FO2N6C25H35 AB2C6D25E35 -46.88 4.73 -8.66 -0.55 0
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315990 126629575 1 ClOSN3C25H30 ABCD3E25F30 35.74 4.21 -8.1 -0.07 0
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315993 126629579 1 FNC10H16 ABC10D16 -40.08 2.95 -8.54 0.23 0
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315995 126629589 1 N2O3C21H40 A2B3C21D40 -223.19 2.48 -9.68 0.98 0
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315996 126629590 1 Cl3N4O4C16H27 A3B4C4D16E27 -207.66 4.56 -9.11 -0.49 0
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315998 126629593 1 FC9H15 AB9C15 -54.77 1.77 -9.35 0.86 0
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316000 126629596 2 O2C9H11 A2B9C11 -128.17 1.93 -8.12 0.24 0
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316001 126629600 1 O3C16H18 A3B16C18 -106.21 2.22 -8.63 0.13 0
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316003 126629608 1 N4C15H20 A4B15C20 67.65 2.15 -8.82 -0.6 0
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316004 126629609 1 N6C13H16 A6B13C16 145.23 1.86 -8.44 -1.64 0
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316005 126629612 1 FON6C24H33 ABC6D24E33 -12.81 3.03 -8.54 -0.48 0
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316007 126629616 1 NPSO4C7H16 ABCD4E7F16 -262.78 1.07 -9.62 -0.19 0
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316008 126629618 1 ClON5C14H20 ABC5D14E20 5.18 3.73 -7.96 -0.05 0
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316010 126629624 1 BrClPN4O10C24H31 ABCD4E10F24G31 -490.61 8.36 -9.47 -0.72 0
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316011 126629625 1 BrClPN3O10C22H28 ABCD3E10F22G28 -473.38 7.05 -9.1 -1.58 0