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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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228602 87565391 1 BrON4C9H9 ABC4D9E9 36.4 4.13 -10.08 -0.78 0
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228603 87565396 1 ClFSN4O4C23H26 ABCD4E4F23G26 -137.24 5.85 -9.59 -1.2 0
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228604 87565402 1 ON2C18H18 AB2C18D18 49.63 6.09 -9.06 -0.7 0
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228605 87565403 2 NC9H10 AB9C10 99.31 3.33 -8.93 -0.58 0
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228606 87565404 2 OSN4C12H14 ABC4D12E14 76.68 6.04 -8.55 -1.09 0
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228607 87565405 1 O2F6N7C23H25 A2B6C7D23E25 -324.81 13.03 -8.45 -1.82 0
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228608 87565406 1 O2F6N7C23H27 A2B6C7D23E27 -283.07 4.05 -8.72 -0.99 0
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228609 87565410 1 ClFSN3O3C25H31 ABCD3E3F25G31 -111.38 6.31 -8.85 -0.2 1
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228610 87565414 1 NOC13H26 ABC13D26 -46.26 6.36 0.0 0.0 0
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228611 87565417 1 NSH17C19 ABC17D19 124.93 1.65 -8.75 -0.4 0
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228612 87565418 1 NPS2O4C6H14 ABC2D4E6F14 -215.5 2.58 -9.29 -0.69 0
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228613 87565420 1 NH2C4Br9 AB2C4D9 40.74 1.46 -9.82 -2.0 0
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228614 87565422 1 PS2O4C7H17 AB2C4D7E17 -242.42 5.43 -8.25 -0.45 -2
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228615 87565424 1 ZrCl2Si3C26H36 AB2C3D26E36 -62.21 8.75 -6.66 -0.7 -4
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228616 87565425 1 ZrCl2Si3C26H38 AB2C3D26E38 -49.74 2.51 -6.72 -1.36 0
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228617 87565426 1 SN2O2C20H20 AB2C2D20E20 50.08 4.11 -9.08 -1.0 0
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228618 87565428 1 O6C9H20 A6B9C20 -287.86 4.98 -10.19 0.7 0
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228619 87565429 1 O11C16H32 A11B16C32 -497.68 6.55 -10.32 -0.36 0
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228620 87565430 1 O7C9H18 A7B9C18 -327.2 6.33 -10.22 -0.48 0
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228621 87565432 1 NSO5C10H21 ABC5D10E21 -225.16 11.84 -10.01 -0.58 0
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228622 87565433 1 O2F6N7C22H23 A2B6C7D22E23 -300.03 4.08 -8.56 -0.92 0
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228624 87565438 2 O5C7H13 A5B7C13 -459.45 7.21 -10.25 -0.33 0
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228625 87565441 1 S2O3N6H16C18 A2B3C6D16E18 10.41 9.52 -8.98 -1.34 0
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228626 87565444 2 ClNC9H11 ABC9D11 20.98 3.14 -8.98 -0.59 0
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228627 87565445 2 NC9H10 AB9C10 94.65 0.71 -8.76 -0.38 0
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228628 87565446 1 BrNOC7H14 ABCD7E14 -80.13 7.05 -9.52 0.23 0
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228629 87565447 1 FO2S2N7H22C24 AB2C2D7E22F24 52.72 9.1 -8.81 -1.4 0
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228630 87565449 1 S2O4N6H16C23 A2B4C6D16E23 67.34 9.21 -8.83 -1.41 0
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228631 87565450 1 SN5O5C26H29 AB5C5D26E29 -94.43 6.01 -8.78 -0.78 0
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228632 87565451 1 NSO4H9C10 ABC4D9E10 -81.49 3.0 -10.54 -1.7 0
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228633 87565453 1 O4C11H18 A4B11C18 -172.05 1.61 -9.14 -0.11 0
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228634 87565454 1 O4C11H18 A4B11C18 -172.82 1.83 -9.12 -0.12 0
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228635 87565456 1 O3N5F6C20H21 A3B5C6D20E21 -336.04 7.52 -9.2 -1.01 0
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228636 87565457 1 BrNOC13H26 ABCD13E26 -80.99 11.56 -8.3 0.55 1
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228637 87565458 1 NOC13H26 ABC13D26 -47.66 5.14 0.0 0.0 0
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228638 87565459 1 N2O5C21H34 A2B5C21D34 -185.3 4.62 -8.24 0.06 0
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228639 87565461 1 ClNO4C10H12 ABC4D10E12 -151.21 5.48 -9.83 -0.84 0
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228640 87565462 2 O4C5H9 A4B5C9 -358.41 3.6 -10.49 -0.23 0
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228641 87565463 2 NF3C7H7 AB3C7D7 -286.12 4.28 -9.74 0.0 0
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228642 87565465 1 NH23C27 AB23C27 267.52 2.0 -8.78 -0.38 0
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228643 87565467 1 ClS3N5O5H16C18 AB3C5D5E16F18 -63.66 7.46 -8.73 -1.14 0
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228644 87565468 1 N3F6O7H21C22 A3B6C7D21E22 -539.08 13.91 -10.02 -1.92 0
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228645 87565470 1 NOF3S3H6C7 ABC3D3E6F7 -146.29 1.95 -9.4 -1.68 0
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228646 87565474 2 OH3F4C5 AB3C4D5 -467.73 3.61 -9.94 -0.71 0
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228647 87565475 1 ClINSF3O4H10C12 ABCDE3F4G10H12 -252.28 11.15 -10.32 -2.87 0
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228648 87565477 3 O3C4H8 A3B4C8 -423.1 7.43 -10.44 0.01 0
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228649 87565478 1 O7C14H30 A7B14C30 -360.74 4.6 -10.02 0.61 0
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228650 87565479 1 O7C11H24 A7B11C24 -331.55 6.48 -10.18 0.69 0
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228651 87565480 8 OC2H4 AB2C4 -400.79 6.77 -10.16 -0.18 0
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228652 87565483 2 O4C7H15 A4B7C15 -374.1 1.85 -10.18 0.28 0
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228653 87565489 1 NH21C23 AB21C23 230.67 2.35 -9.18 -0.13 0
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228654 87565490 1 NC17H17 AB17C17 90.08 2.0 -9.19 0.14 1
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228655 87565491 1 OPC30H40 ABC30D40 -43.11 6.77 0.0 0.0 0
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228656 87565492 2 O5C7H7 A5B7C7 -85.06 5.03 -10.83 -1.89 0
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228657 87565493 1 NO2F5H10C16 AB2C5D10E16 -263.15 6.02 -9.97 -1.79 0
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228658 87565494 1 ClOF3N3C25H25 ABC3D3E25F25 -147.74 5.35 -9.34 -0.83 0
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228659 87565495 1 ClOF3N3C25H25 ABC3D3E25F25 -150.67 2.57 -9.38 -0.61 0
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228660 87565496 1 SN3F6O6H13C20 AB3C6D6E13F20 -445.5 9.5 -10.38 -1.48 0
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228661 87565498 2 O3C6H13 A3B6C13 -306.1 4.21 -10.22 0.52 0
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228662 87565499 1 O9C10H18 A9B10C18 -418.91 2.99 -10.49 -0.1 0
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228663 87565500 1 NO3F7H12C17 AB3C7D12E17 -438.03 3.18 -10.01 -1.4 0
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228664 87565506 1 ON6C25H32 AB6C25D32 95.8 3.54 -7.92 -0.22 0
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228665 87565507 2 SN3O13C36H63 AB3C13D36E63 -1303.74 7.66 -9.09 -0.03 0
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228666 87565509 1 NSO5C9H17 ABC5D9E17 -220.22 4.46 -8.52 0.24 0
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228667 87565511 1 O3H8C9 A3B8C9 -90.6 0.88 -8.66 -0.32 0
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228668 87565513 1 O3N5F7H18C23 A3B5C7D18E23 -339.68 2.68 -9.49 -1.12 0
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228669 87565515 1 F3O3H19C20 A3B3C19D20 -222.56 4.07 -8.63 -1.08 0
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228670 87565516 1 NC7H13 AB7C13 13.3 2.17 -9.07 0.33 0
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228671 87565517 1 BrNO2F7H13C18 ABC2D7E13F18 -413.04 4.4 -9.99 -1.56 0
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228672 87565518 1 F3O3N4H17C18 A3B3C4D17E18 -195.54 4.66 -8.96 -0.83 -4
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228673 87565520 1 SiZrCl2C16H26 ABC2D16E26 -101.57 9.36 -6.82 -0.93 0
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228674 87565523 1 Br2O2C15H28 A2B2C15D28 -153.3 2.84 -10.52 -1.1 0
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228676 87565526 1 NO3F9H22C27 AB3C9D22E27 -556.9 8.13 -9.18 -1.53 0
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228677 87565527 1 INO6C17H30 ABC6D17E30 -304.82 2.72 -9.96 -1.33 -4
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228679 87565529 1 O2H10C11 A2B10C11 -35.16 4.42 -9.22 -0.52 0