我在出现问题时已经想到这点了，但是从输出文件中看不出来
没有任何出错提示
我拿相同的输入文件进行了计算，两次结果一样
将高斯卸载，重新启动windows，重新安装高斯，进行计算后还是如此。
换了一台计算机，新安装的高斯
进行相同的计算，出现相同的错误，而且输出文件的内容一致，都是好像突然断掉的样子
输出文件的最后部分如下，请帮我看看，偶是新手，不大懂的，谢谢！
【 在 ghb (G. H.B.) 的大作中提到: 】
: 贴最后那段, 看看在哪里死掉的 (died at L***)
IRC-IRC-IRC-IRC-IRC-IRC-IRC-IRC-IRC-IRC-IRC-IRC-IRC-IRC-IRC-IRC-IRC-IRC
------------------------------------------------------------------------
Z-MATRIX (ANGSTROMS AND DEGREES)
CD Cent Atom N1 Length/X N2 Alpha/Y N3 Beta/Z J
------------------------------------------------------------------------
1 1 O 0 0.069437 0.000294 -3.706811
2 2 C 0 0.067621 0.000179 -2.354022
3 3 C 0 1.256174 0.000192 -1.633197
4 4 C 0 1.239799 0.000101 -0.256332
5 5 C 0 0.030621 0.000014 0.439749
6 6 C 0 -1.157232 -0.000034 -0.272422
7 7 C 0 -1.121551 0.000046 -1.661694
8 8 N 0 0.111852 0.000151 1.848846
9 9 C 0 -0.896836 -0.000430 2.762543
10 10 O 0 -2.062065 -0.001588 2.484693
11 11 C 0 -0.444934 0.000699 4.209380
12 12 H 0 0.964049 0.000315 -4.022344
13 13 H 0 2.174972 0.000104 0.280440
14 14 H 0 -2.094114 -0.000148 0.240060
15 15 H 0 -2.038111 0.000018 -2.222064
16 16 H 0 1.034926 0.001071 2.215279
17 17 H 0 0.630500 0.000519 4.338016
18 18 H 0 -0.859128 -0.872693 4.696890
19 19 H 0 -0.858612 0.875208 4.695356
20 20 O 0 2.399286 0.000306 -2.371551
21 21 H 0 3.167437 0.000117 -1.818340
------------------------------------------------------------------------
Distance matrix (angstroms):
1 2 3 4 5
1 O 0.000000
2 C 1.352789 0.000000
3 C 2.389187 1.390052 0.000000
4 C 3.643563 2.402979 1.376963 0.000000
5 C 4.146741 2.794016 2.408128 1.395220 0.000000
6 C 3.646881 2.415228 2.770602 2.397085 1.384984
7 C 2.366634 1.376027 2.377896 2.747912 2.396573
8 N 5.555819 4.203102 3.665256 2.388313 1.411437
9 C 6.541117 5.206671 4.894689 3.698488 2.501110
10 O 6.548131 5.286656 5.288452 4.291331 2.925942
11 C 7.932884 6.583385 6.085185 4.772934 3.799509
12 H 0.948626 1.893906 2.406940 3.776094 4.558679
13 H 4.509040 3.373621 2.122781 1.078273 2.150261
14 H 4.500971 3.376739 3.838427 3.370665 2.134098
15 H 2.578029 2.109863 3.346501 3.822145 3.371186
16 H 6.000276 4.670566 3.854830 2.480087 2.039886
17 H 8.064368 6.715669 6.003903 4.634574 3.944153
18 H 8.499795 7.164924 6.731005 5.449924 4.435823
19 H 8.498421 7.163611 6.729678 5.448702 4.434738
20 O 2.685351 2.331731 1.360836 2.412170 3.676137
21 H 3.628212 3.145761 1.920210 2.481060 3.865045
6 7 8 9 10
6 C 0.000000
7 C 1.389730 0.000000
8 N 2.471913 3.720911 0.000000
9 C 3.046115 4.429940 1.360990 0.000000
10 O 2.901794 4.251717 2.264999 1.197898 0.000000
11 C 4.538052 5.909934 2.425310 1.515768 2.364247
12 H 4.308334 3.149983 5.932716 7.035452 7.176273
13 H 3.377756 3.826088 2.591595 3.949284 4.776109
14 H 1.067889 2.136012 2.730290 2.792202 2.244862
15 H 2.139404 1.074288 4.603765 5.113591 4.706818
16 H 3.315752 4.436363 0.993145 2.007786 3.108688
17 H 4.944909 6.250297 2.542629 2.194282 3.268749
18 H 5.054153 6.423561 3.133051 2.122254 2.664525
19 H 5.053123 6.422394 3.132115 2.122256 2.665353
20 O 4.129790 3.591684 4.800428 6.101094 6.594450
21 H 4.592670 4.291848 4.773348 6.123953 6.772281
11 12 13 14 15
11 C 0.000000
12 H 8.351437 0.000000
13 H 4.722338 4.469931 0.000000
14 H 4.298290 5.245993 4.269277 0.000000
15 H 6.625834 3.500567 4.900264 2.462761 0.000000
16 H 2.483229 6.238025 2.245731 3.700322 5.397551
17 H 1.083100 8.367011 4.341580 4.921054 7.082099
18 H 1.082606 8.950483 5.428864 4.706364 7.072733
19 H 1.082622 8.949069 5.427700 4.705569 7.071625
20 O 7.169257 2.187469 2.661461 5.197226 4.439914
21 H 7.027278 3.116497 2.321608 5.649861 5.221180
16 17 18 19 20
16 H 0.000000
17 H 2.160920 0.000000
18 H 3.241805 1.763599 0.000000
19 H 3.240430 1.763584 1.747901 0.000000
20 O 4.785446 6.938797 7.832130 7.830743 0.000000
21 H 4.562640 6.658586 7.708647 7.707340 0.946625
21
21 H 0.000000
Interatomic angles:
O1-C2-C3=121.1588 O1-C2-C4=150.7269 O1-C3-C4=149.536
C2-C3-C4=120.5543 O1-C2-C5=179.3181 O1-C3-C5=119.6252
C2-C3-C5= 90.6436 C2-C4-C5= 90.7313 C3-C4-C5=120.6089
O1-C2-C6=149.6035 O1-C3-C6= 89.6334 C3-C2-C6= 89.2377
C2-C4-C6= 60.4192 C3-C4-C6= 90.2968 C2-C6-C5= 90.4712
C3-C5-C6= 89.6476 C4-C5-C6=119.1279 O1-C2-C7=120.2846
O1-C7-C3= 60.472 C3-C2-C7=118.5566 O1-C7-C4= 90.5444
C4-C2-C7= 88.9885 C4-C3-C7= 90.0053 O1-C7-C5=121.0504
C2-C7-C5= 91.4727 C3-C7-C5= 60.5784 C4-C5-C7= 88.8075
O1-C7-C6=151.2565 C2-C7-C6=121.6788 C3-C7-C6= 90.7845
C4-C6-C7= 88.9134 C5-C6-C7=119.4734 C2-C4-N8=122.6215
C3-C4-N8=152.4991 C2-C5-N8=175.9419 C3-C5-N8=146.1086
C4-C5-N8=116.6282 C2-C6-N8=118.636 C3-C6-N8= 88.5254
C6-C4-N8= 62.2024 C6-C5-N8=124.2439 C7-C4-N8= 92.5768
C7-C5-N8=154.5644 C7-C6-N8=147.6381 C2-C5-C9=158.9927
C3-C5-C9=171.174 C4-C5-C9=141.6936 C6-C5-C9= 99.1785
C7-C5-C9=129.499 C4-N8-C9=160.3533 C5-N8-C9=128.8718
C6-N8-C9=101.2804 C2-C5-O10=135.0977 C3-C5-O10=164.931
C4-C5-O10=165.5885 C2-C6-O10=167.6955 C3-C6-O10=137.5849
C4-C6-O10=107.7843 C5-C6-O10= 77.2243 C7-C5-O10=105.604
C7-C6-O10=163.3023 C4-N8-O10=134.4858 C5-N8-O10=103.0043
C6-N8-O10= 75.4129 C5-C9-O10= 98.3543 C6-O10-C9= 85.2429
N8-C9-O10=124.4171 C4-N8-C11=165.0897 C5-N8-C11=163.4287
C6-N8-C11=135.8374 C5-C9-C11=140.8883 N8-C9-C11=114.8255
C5-O10-C11= 91.1823 C6-O10-C11=118.6745 N8-O10-C11= 63.147
O10-C9-C11=120.7574 C2-O1-H12=109.5049 C3-O1-H12= 79.6453
C3-C2-H12= 92.9855 C4-C2-H12=122.5536 C4-C3-H12=172.3476
C5-C2-H12=152.5086 C5-C3-H12=142.4368 C6-C2-H12=177.7768
C6-C3-H12=112.445 C7-O1-H12=139.6427 C7-C2-H12=148.4578
C7-C3-H12= 82.3423 O1-C3-H13=175.8645 C2-C3-H13=146.8829
C2-C4-H13=149.0512 C3-C4-H13=119.1736 C2-C5-H13= 84.9924
C3-H13-C5= 68.6017 C5-C4-H13=120.2175 C6-C3-H13= 86.2311
C6-C4-H13=150.5296 C6-C5-H13=144.8066 C7-C3-H13=116.3338
C7-C4-H13=179.0959 C7-C5-H13=114.4861 C3-H13-N8=101.5953
N8-C4-H13= 88.3272 N8-C5-H13= 90.9495 C6-N8-H13= 83.6482
C9-C5-H13=116.0149 C9-N8-H13=175.0713 O10-C5-H13=139.9099
O10-N8-H13=159.0611 C11-N8-H13=140.5144 H12-C3-H13=161.3239
C2-C5-H14= 85.3897 C3-C5-H14=115.2231 C4-C5-H14=144.7035
C2-C6-H14=149.1524 C3-C6-H14=179.263 C4-C6-H14=150.9364
C5-C6-H14=120.3764 O1-C7-H14=176.8706 C2-C7-H14=147.293
C3-C7-H14=116.3987 C4-C7-H14= 86.3263 C5-H14-C7= 68.2837
C7-C6-H14=120.1502 C4-N8-H14= 82.0794 N8-C5-H14= 98.6684
N8-C6-H14= 92.2117 C7-H14-N8= 99.0175 C9-C5-H14= 73.6029
C6-H14-C9= 93.288 C7-H14-C9=127.5237 C9-N8-H14= 78.274
C5-H14-O10= 83.8129 C6-H14-O10=117.861 C7-H14-O10=152.0966
N8-O10-H14= 74.5144 C9-O10-H14=104.2298 C11-N8-H14=112.8309
C11-C9-H14=171.9544 C11-O10-H14=137.6614 H13-C5-H14=170.3821
H13-N8-H14=106.6547 O1-C2-H15= 93.6627 C3-O1-H15= 84.6183
C3-C2-H15=145.1785 C4-C2-H15=115.6104 C5-C2-H15= 85.6554
O1-H15-C6=100.8501 C2-H15-C6= 69.2716 C3-C6-H15= 84.8982
C4-C6-H15=114.6988 C5-C6-H15=145.2588 O1-C7-H15= 88.7738
C2-C7-H15=118.3514 C3-C7-H15=149.2457 C4-C7-H15=179.3181
C5-C7-H15=150.1759 C6-C7-H15=119.9698 N8-C6-H15=173.4235
O10-C6-H15=137.5169 H12-O1-H15=164.2636 H12-C2-H15=121.836
O1-H15-H14=126.4673 C2-H15-H14= 94.8889 C5-H14-H15= 94.066
H14-C6-H15= 94.3648 H14-C7-H15= 94.3556 N8-H14-H15=124.7998
C9-H14-H15=153.306 O10-H14-H15=177.8787 C2-C4-H16=146.0653
C3-C4-H16=175.9428 C2-C5-H16=149.7471 C3-C5-H16=119.9138
C4-C5-H16= 90.4334 C6-C4-H16= 85.6462 C6-C5-H16=150.4386
C7-C4-H16=116.0206 C7-C5-H16=179.2402 C4-N8-H16= 83.4693
C5-N8-H16=114.9509 C6-N8-H16=142.5422 C4-H16-C9=110.5557
C5-H16-C9= 76.3232 C9-N8-H16=116.1773 O10-C5-H16= 75.1552
O10-N8-H16=142.0448 O10-C9-H16=150.7709 C4-H16-C11=148.1586
C5-H16-C11=113.9261 C11-N8-H16= 81.6204 C11-C9-H16= 88.4717
O10-C11-H16= 79.7364 C3-H13-H16=123.8454 C4-H13-H16= 89.3475
H13-C5-H16= 64.7547 N8-H16-H13= 98.8559 C9-H16-H13=136.3247
C11-H16-H13=173.9276 H14-C5-H16=124.8631 H14-N8-H16=165.5486
H14-C9-H16= 99.5737 C4-N8-H17=140.0479 C5-N8-H17=171.5295
C6-N8-H17=160.8792 C5-C9-H17=114.1227 N8-C9-H17= 88.0599
O10-N8-H17= 85.4663 O10-C9-H17=147.523 N8-C11-H17= 83.549
C9-C11-H17=114.1665 O10-C11-H17=139.9775 H13-N8-H17=115.4726
H14-N8-H17=137.8727 H14-C9-H17=161.2798 C4-H16-H17=173.9516
C5-H16-H17=139.7191 N8-H16-H17=100.8648 C9-H16-H17= 63.3959
C11-H17-H16= 93.9658 H13-H16-H17=160.2793 C5-C9-H18=147.136
N8-C9-H18=126.792 C5-O10-H18=104.9242 C6-O10-H18=130.4095
N8-O10-H18= 78.4638 O10-C9-H18=103.1968 N8-C11-H18=121.7312
C9-C11-H18=108.3711 O10-C11-H18= 93.7858 H14-C9-H18=146.2093
H14-O10-H18=146.8049 H16-C9-H18=103.3942 H16-C11-H18=126.1382
N8-H17-H18= 91.5384 C9-H18-H17= 68.0395 O10-H18-H17= 92.8954
H17-C11-H18=109.0423 H16-H17-H18=110.9836 C5-C9-H19=147.0402
N8-C9-H19=126.7192 C5-O10-H19=104.8661 C6-O10-H19=130.3223
N8-O10-H19= 78.4176 O10-C9-H19=103.2478 N8-C11-H19=121.655
C9-C11-H19=108.3703 O10-C11-H19= 93.8348 H14-C9-H19=146.1442
H14-O10-H19=146.674 H16-C9-H19=103.3325 H16-C11-H19=126.0197
N8-H17-H19= 91.5012 C9-H19-H17= 68.0397 O10-H19-H17= 92.868
H17-C11-H19=109.0397 H16-H17-H19=110.9125 C9-H18-H19= 65.6819
O10-H18-H19= 70.8816 H18-C11-H19=107.6582 H17-H19-H18= 60.2943
O1-C2-O20= 89.4924 O1-C3-O20= 86.9236 C2-C3-O20=115.9053
O1-O20-C4= 91.0875 C4-C2-O20= 61.2345 C4-C3-O20=123.5404
C5-C2-O20= 91.1895 C5-C3-O20=153.4512 C5-C4-O20=148.6575
C6-C2-O20=120.9041 C6-C3-O20=176.557 C6-C4-O20=118.3454
C7-O1-O20= 90.3973 C7-C2-O20=150.2231 C7-C3-O20=146.4543
C7-C4-O20= 87.9709 N8-C4-O20=179.4522 O1-H12-O20=111.5765
C2-H12-O20= 69.2546 C3-O20-H12= 81.8546 C4-O20-H12=110.2656
O1-O20-H13=114.9827 C2-O20-H13= 84.7345 H13-C3-O20= 97.2119
H13-C4-O20= 91.125 C5-H13-O20= 99.0836 N8-H13-O20=132.0773
H12-O20-H13=134.1608 H15-O1-O20=115.0182 H15-C2-O20=176.8449
H16-C4-O20=156.0085 H16-H13-O20=154.3273 O1-C3-H21=114.2497
C2-C3-H21=143.2314 C2-C4-H21= 80.1776 C4-C3-H21= 96.2143
C5-C3-H21=126.1251 C5-C4-H21=170.9089 C6-C3-H21=156.1169
C6-C4-H21=140.5968 C7-C3-H21=173.7804 C7-C4-H21=110.2223
N8-C4-H21=157.2009 H12-C3-H21= 91.4381 H13-C3-H21= 69.8858
C4-H13-H21= 85.4534 C5-H13-H21=119.5572 N8-H13-H21=152.5509
H16-C4-H21=133.7571 H16-H13-H21=174.8009 O1-O20-H21=174.0565
C2-O20-H21=143.8084 C3-O20-H21=111.38 C4-O20-H21= 82.9691
H12-O20-H21=166.7654 H13-H21-O20=100.4525
Framework group C1[X(C8H9NO3)]
Deg. of freedom 57
Standard orientation:
---------------------------------------------------------------------
Center Atomic Atomic Coordinates (Angstroms)
Number Number Type X Y Z
---------------------------------------------------------------------
1 8 0 -3.581413 -0.958509 0.000295
2 6 0 -2.280894 -0.586097 0.000165
3 6 0 -1.916920 0.755457 -0.000135
4 6 0 -0.589237 1.120537 -0.000239
5 6 0 0.414126 0.151052 -0.000025
6 6 0 0.058276 -1.187436 0.000240
7 6 0 -1.286670 -1.537396 0.000327
8 7 0 1.745789 0.618846 0.000074
9 6 0 2.902827 -0.097783 -0.000260
10 8 0 2.958097 -1.294405 -0.001117
11 6 0 4.168236 0.736660 0.000735
12 1 0 -4.132070 -0.186067 0.000092
13 1 0 -0.332056 2.167691 -0.000482
14 1 0 0.809891 -1.946028 0.000360
15 1 0 -1.571676 -2.573188 0.000541
16 1 0 1.842621 1.607259 0.000753
17 1 0 3.994408 1.805720 0.000279
18 1 0 4.751338 0.473243 -0.872556
19 1 0 4.749619 0.473750 0.875345
20 8 0 -2.942636 1.649761 -0.000305
21 1 0 -2.623461 2.540955 -0.000698
---------------------------------------------------------------------
Rotational constants (GHZ): 2.5521789 0.4757407 0.4019753
--
FROM 58.240.127.*