Assignment w1 w2 I3H-N 120.959 6.392 T4H-N 116.174 8.056 L5H-N 122.911 9.633 S6H-N 115.643 8.622 D7H-N 121.015 9.052 S8H-N 115.516 8.846 A9H-N 126.501 8.303 A10H-N 120.325 8.709 A11H-N 118.726 7.937 R12H-N 118.922 7.538 V13H-N 118.991 8.48 N14H-N 117.883 8.541 T15H-N 118.177 8.084 F16H-N 122.13 8.156 L17H-N 120.254 8.749 A18H-N 123.341 8.093 N19H-N 116.196 8.012 N19HD21-ND2 111.652 6.9 R20H-N 120.401 7.897 G21H-N 106.091 7.761 K22H-N 115.363 7.492 G23H-N 108.379 8.508 F24H-N 122.861 9.064 G25H-N 102.653 7.683 L26H-N 123.841 8.837 R27H-N 125.388 9.576 L28H-N 126.113 8.041 G29H-N 111.089 8.834 V30H-N 113.54 8.255 T32H-N 115.88 8.426 S33H-N 118.028 8.014 M38H-N 121.149 8.109 A39H-N 125.022 8.314 Y40H-N 119.127 8.114 V41H-N 121.22 8.392 L42H-N 126.526 8.205 E43H-N 120.8 8.403 F44H-N 121.013 8.916 V45H-N 116.446 8.492 T49H-N 115.623 9.738 E51H-N 113.976 7.583 D52H-N 120.926 7.467 I53H-N 124.582 9.224 V54H-N 124.818 8.034 F55H-N 128.255 9.576 E56H-N 120.3 8.651 D57H-N 125.091 8.807 K58H-N 121.135 8.805 G59H-N 103.741 8.705 V60H-N 123.676 8.13 K61H-N 125.082 8.777 V62H-N 124.26 9.037 V63H-N 126.026 9.401 V64H-N 123.357 8.945 D65H-N 126.862 9.041 G66H-N 111.253 8.578 K67H-N 120.03 8.412 S68H-N 114.963 8.303 L69H-N 122.953 7.69 Q70H-N 115.636 8.308 F71H-N 115.397 7.292 L72H-N 115.369 7.531 D73H-N 122.035 8.467 G74H-N 114.12 8.068 T75H-N 118.603 7.871 Q76H-N 123.947 8.523 L77H-N 128.661 9.033 D78H-N 125.106 9.014 F79H-N 123.385 8.905 V80H-N 126.69 7.995 E82H-N 121.274 8.28 G83H-N 109.719 8.374 G87H-N 109.183 7.708 F88H-N 118.069 8.757 K89H-N 120.944 8.437 T91H-N 119.691 8.704 N94H-N 115.677 8.297 V95H-N 118.717 7.445 K96H-N 125.428 8.474 D97H-N 122.326 8.378 E98H-N 121.583 8.564 C99H-N 119.945 8.45 G100H-N 111.11 8.524 C101H-N 118.794 8.449 G102H-N 111.822 8.666 E103H-N 120.845 8.308 S104H-N 116.615 8.322 F105H-N 121.753 8.361 H106H-N 121.519 8.139 V107H-N 125.141 7.78