0 mol 19 unq 0 iso 0 dist 8.4674 4.51865 5.80928 6.20943 5.14627 4.69858 7.67038 4.54938 6.864 7.82528 10.4091 7.34551 7.07775 10.4988 7.20519 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 4.54938 7.20519 7.34551 8.78293 10.9543 5.31524 7.67038 8.4674 10.4091 13.4721 6.864 5.80928 7.07775 11.4401 4.51865 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 4.54938 7.20519 7.34551 8.23643 6.55187 11.0832 7.67038 8.4674 10.4091 14.6255 6.864 5.80928 7.07775 12.3093 4.51865 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 4.54938 7.20519 7.34551 7.82528 5.14627 10.4988 7.67038 8.4674 10.4091 6.20943 6.864 5.80928 7.07775 4.69858 4.51865 numMergedOcc 0
4 mol 19 unq 4 iso 0 dist 4.51865 8.4674 5.80928 6.20943 4.69858 5.14627 7.67038 6.864 4.54938 7.82528 10.4091 7.07775 7.34551 10.4988 7.20519 numMergedOcc 0
5 mol 19 unq 5 iso 0 dist 4.51865 6.864 7.67038 8.58657 6.74265 5.5841 5.80928 8.4674 4.54938 9.58539 11.0366 10.3915 5.03957 7.42082 7.82074 numMergedOcc 0
6 mol 19 unq 6 iso 0 dist 6.864 7.20519 7.07775 8.78293 11.4401 5.31524 7.67038 4.51865 10.4091 13.4721 4.54938 5.80928 7.34551 10.9543 8.4674 numMergedOcc 0
7 mol 19 unq 7 iso 0 dist 6.864 7.20519 7.07775 8.23643 12.3093 11.0832 7.67038 4.51865 10.4091 14.6255 4.54938 5.80928 7.34551 6.55187 8.4674 numMergedOcc 0
8 mol 19 unq 8 iso 0 dist 6.864 7.20519 7.07775 7.82528 4.69858 10.4988 7.67038 4.51865 10.4091 6.20943 4.54938 5.80928 7.34551 5.14627 8.4674 numMergedOcc 0
9 mol 19 unq 9 iso 0 dist 6.864 4.51865 7.67038 8.58657 5.5841 6.74265 5.80928 4.54938 8.4674 9.58539 11.0366 5.03957 10.3915 7.42082 7.82074 numMergedOcc 0
10 mol 58 unq 0 iso 0 dist 9.55426 6.81627 9.7274 8.26899 10.3782 5.98837 10.6169 9.4099 15.2973 13.7148 13.4544 6.47414 15.6564 14.7581 6.64012 numMergedOcc 0
11 mol 58 unq 1 iso 0 dist 9.55426 7.32874 5.90225 8.26899 10.3782 4.55117 10.6169 9.4099 11.396 13.7148 13.4544 6.47414 11.0466 14.7581 6.64012 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 7.97049 6.19965 5.42586 9.47876 7.98917 11.6116 6.9948 7.47541 7.66905 7.22293 11.2656 6.87425 10.1164 6.47779 5.73196 numMergedOcc 0
13 mol 85 unq 1 iso 0 dist 7.47541 5.73196 6.87425 7.22293 7.98917 6.47779 6.9948 7.97049 11.2656 9.47876 7.66905 5.42586 10.1164 11.6116 6.19965 numMergedOcc 0
14 mol 85 unq 2 iso 0 dist 6.19965 7.97049 5.42586 9.47876 11.6116 7.98917 6.9948 7.66905 7.47541 7.22293 11.2656 10.1164 6.87425 6.47779 5.73196 numMergedOcc 0
15 mol 85 unq 3 iso 0 dist 7.66905 5.73196 10.1164 7.22293 11.6116 6.47779 6.9948 6.19965 11.2656 9.47876 7.47541 5.42586 6.87425 7.98917 7.97049 numMergedOcc 0
16 mol 100 unq 0 iso 0 dist 9.60661 7.17106 11.5403 6.58204 10.9608 5.01145 5.88134 6.65086 10.5134 7.75343 12.0662 8.8807 17.5254 15.209 7.47343 numMergedOcc 0
17 mol 100 unq 1 iso 0 dist 9.60661 7.17106 11.5403 6.58204 10.9608 5.01145 5.88134 6.65086 10.5134 7.75343 9.35224 7.80879 8.87654 5.69137 6.56369 numMergedOcc 0
18 mol 100 unq 2 iso 0 dist 9.60661 7.17106 11.5403 6.58204 10.9608 5.01145 5.88134 6.65086 10.5134 7.75343 10.5853 5.38414 8.7812 9.21622 9.30209 numMergedOcc 0
19 mol 100 unq 3 iso 0 dist 9.60661 9.35224 7.80879 6.58204 10.9608 5.69137 5.88134 6.65086 6.56369 7.75343 12.0662 8.8807 12.6515 15.209 7.47343 numMergedOcc 0
20 mol 100 unq 4 iso 0 dist 9.60661 9.35224 7.80879 6.58204 10.9608 5.69137 5.88134 6.65086 6.56369 7.75343 10.5853 5.38414 6.39938 9.21622 9.30209 numMergedOcc 0
21 mol 100 unq 5 iso 0 dist 9.35224 9.60661 7.80879 6.58204 5.69137 10.9608 5.88134 6.56369 6.65086 7.75343 12.0662 12.6515 8.8807 15.209 7.47343 numMergedOcc 0
22 mol 100 unq 6 iso 0 dist 9.35224 9.60661 7.80879 6.58204 5.69137 10.9608 5.88134 6.56369 6.65086 7.75343 10.5853 6.39938 5.38414 9.21622 9.30209 numMergedOcc 0
23 mol 100 unq 7 iso 0 dist 9.35224 7.17106 8.87654 6.58204 5.69137 5.01145 5.88134 6.56369 10.5134 7.75343 12.0662 12.6515 17.5254 15.209 7.47343 numMergedOcc 0
24 mol 100 unq 8 iso 0 dist 9.35224 7.17106 8.87654 6.58204 5.69137 5.01145 5.88134 6.56369 10.5134 7.75343 9.60661 7.80879 11.5403 10.9608 6.65086 numMergedOcc 0
25 mol 100 unq 9 iso 0 dist 9.35224 7.17106 8.87654 6.58204 5.69137 5.01145 5.88134 6.56369 10.5134 7.75343 10.5853 6.39938 8.7812 9.21622 9.30209 numMergedOcc 0
26 mol 100 unq 10 iso 0 dist 7.47343 6.45675 5.33144 8.72704 10.1589 7.2495 8.8807 6.65086 10.1409 10.5193 12.0662 5.88134 7.1752 10.1499 9.60661 numMergedOcc 0
27 mol 100 unq 11 iso 0 dist 7.47343 6.45675 5.33144 8.72704 10.1589 7.2495 12.6515 6.56369 11.8665 15.8984 12.0662 5.88134 7.1752 10.1499 9.35224 numMergedOcc 0
28 mol 100 unq 12 iso 0 dist 7.47343 8.86688 10.1407 8.72704 10.1589 15.9331 8.8807 6.65086 14.9102 10.5193 12.0662 5.88134 14.8365 10.1499 9.60661 numMergedOcc 0
29 mol 100 unq 13 iso 0 dist 7.47343 8.86688 10.1407 8.72704 10.1589 15.9331 12.6515 6.56369 13.6959 15.8984 12.0662 5.88134 14.8365 10.1499 9.35224 numMergedOcc 0
30 mol 100 unq 14 iso 0 dist 6.65086 7.47343 8.8807 7.75343 10.9608 15.209 5.88134 9.60661 12.0662 6.58204 10.5134 11.5403 17.5254 5.01145 7.17106 numMergedOcc 0
31 mol 100 unq 15 iso 0 dist 6.65086 7.47343 8.8807 7.75343 10.9608 15.209 5.88134 9.60661 12.0662 6.58204 6.56369 7.80879 12.6515 5.69137 9.35224 numMergedOcc 0
32 mol 100 unq 16 iso 0 dist 6.65086 6.56369 7.80879 7.75343 10.9608 5.69137 5.88134 9.60661 9.35224 6.58204 10.5134 11.5403 8.87654 5.01145 7.17106 numMergedOcc 0
33 mol 100 unq 17 iso 0 dist 6.65086 9.30209 5.38414 7.75343 10.9608 9.21622 5.88134 9.60661 10.5853 6.58204 10.5134 11.5403 8.7812 5.01145 7.17106 numMergedOcc 0
34 mol 100 unq 18 iso 0 dist 6.65086 9.30209 5.38414 7.75343 10.9608 9.21622 5.88134 9.60661 10.5853 6.58204 6.56369 7.80879 6.39938 5.69137 9.35224 numMergedOcc 0
35 mol 100 unq 19 iso 0 dist 6.56369 7.47343 12.6515 7.75343 5.69137 15.209 5.88134 9.35224 12.0662 6.58204 6.65086 7.80879 8.8807 10.9608 9.60661 numMergedOcc 0
36 mol 100 unq 20 iso 0 dist 6.56369 7.47343 12.6515 7.75343 5.69137 15.209 5.88134 9.35224 12.0662 6.58204 10.5134 8.87654 17.5254 5.01145 7.17106 numMergedOcc 0
37 mol 100 unq 21 iso 0 dist 6.56369 6.65086 7.80879 7.75343 5.69137 10.9608 5.88134 9.35224 9.60661 6.58204 10.5134 8.87654 11.5403 5.01145 7.17106 numMergedOcc 0
38 mol 100 unq 22 iso 0 dist 6.56369 9.30209 6.39938 7.75343 5.69137 9.21622 5.88134 9.35224 10.5853 6.58204 6.65086 7.80879 5.38414 10.9608 9.60661 numMergedOcc 0
39 mol 100 unq 23 iso 0 dist 6.56369 9.30209 6.39938 7.75343 5.69137 9.21622 5.88134 9.35224 10.5853 6.58204 10.5134 8.87654 8.7812 5.01145 7.17106 numMergedOcc 0
40 mol 115 unq 0 iso 0 dist 9.33865 6.11741 8.02349 9.66954 6.09023 4.61908 7.69052 5.83991 7.88312 8.66155 13.8473 10.8507 11.5723 11.3902 7.30858 numMergedOcc 0
41 mol 115 unq 1 iso 0 dist 9.33865 6.11741 8.02349 7.64585 10.2377 10.8939 7.69052 5.83991 7.88312 12.2309 13.8473 10.8507 11.5723 19.2193 7.30858 numMergedOcc 0
42 mol 115 unq 2 iso 0 dist 5.83991 7.30858 10.8507 8.66155 6.09023 11.3902 7.69052 9.33865 13.8473 9.66954 7.88312 8.02349 11.5723 4.61908 6.11741 numMergedOcc 0
43 mol 115 unq 3 iso 0 dist 6.11741 9.33865 8.02349 9.66954 4.61908 6.09023 7.69052 7.88312 5.83991 8.66155 13.8473 11.5723 10.8507 11.3902 7.30858 numMergedOcc 0
44 mol 115 unq 4 iso 0 dist 6.11741 9.33865 8.02349 7.64585 10.8939 10.2377 7.69052 7.88312 5.83991 12.2309 13.8473 11.5723 10.8507 19.2193 7.30858 numMergedOcc 0
45 mol 115 unq 5 iso 0 dist 7.88312 7.30858 11.5723 8.66155 4.61908 11.3902 7.69052 6.11741 13.8473 9.66954 5.83991 8.02349 10.8507 6.09023 9.33865 numMergedOcc 0
46 mol 134 unq 0 iso 0 dist 8.94367 9.86662 6.81259 8.79571 5.41704 6.17103 8.80819 6.49416 12.5075 8.6355 11.9139 5.00526 11.3271 10.1448 6.54501 numMergedOcc 0
47 mol 134 unq 1 iso 0 dist 6.37586 9.71307 6.81259 5.42582 5.41704 6.17103 5.00817 6.49416 12.5075 8.6355 9.5126 5.00526 11.3271 10.1448 6.54501 numMergedOcc 0
48 mol 134 unq 2 iso 0 dist 6.49416 6.54501 5.00526 8.6355 5.41704 10.1448 8.80819 8.94367 11.9139 8.79571 12.5075 6.81259 11.3271 6.17103 9.86662 numMergedOcc 0
49 mol 134 unq 3 iso 0 dist 6.49416 6.54501 5.00526 8.6355 5.41704 10.1448 5.00817 6.37586 9.5126 5.42582 12.5075 6.81259 11.3271 6.17103 9.71307 numMergedOcc 0
50 mol 142 unq 0 iso 0 dist 9.2313 8.96657 11.1395 7.15475 9.49653 10.3477 5.32922 5.31024 11.0824 9.07935 7.73169 5.50998 5.92693 7.53854 7.26382 numMergedOcc 0
51 mol 142 unq 1 iso 0 dist 5.31024 7.26382 5.50998 9.07935 9.49653 7.53854 5.32922 9.2313 7.73169 7.15475 11.0824 11.1395 5.92693 10.3477 8.96657 numMergedOcc 0
52 mol 142 unq 2 iso 0 dist 7.73169 8.96657 5.92693 7.15475 7.53854 10.3477 5.32922 7.26382 11.0824 9.07935 9.2313 5.50998 11.1395 9.49653 5.31024 numMergedOcc 0
53 mol 142 unq 3 iso 0 dist 7.26382 5.31024 5.50998 9.07935 7.53854 9.49653 5.32922 7.73169 9.2313 7.15475 11.0824 5.92693 11.1395 10.3477 8.96657 numMergedOcc 0
54 mol 152 unq 0 iso 0 dist 6.70283 8.56324 7.65448 9.13561 8.25411 5.99333 5.42328 5.87555 10.399 12.4808 7.16148 5.49936 10.6875 7.89109 8.87437 numMergedOcc 0
55 mol 152 unq 1 iso 0 dist 6.70283 8.56324 7.65448 9.13561 8.25411 5.99333 6.4896 8.67331 14.1618 14.1119 7.16148 5.49936 10.6875 7.89109 8.05741 numMergedOcc 0
56 mol 152 unq 2 iso 0 dist 7.16148 8.56324 10.6875 9.13561 7.89109 5.99333 5.42328 8.87437 10.399 12.4808 6.70283 5.49936 7.65448 8.25411 5.87555 numMergedOcc 0
57 mol 152 unq 3 iso 0 dist 7.16148 8.56324 10.6875 9.13561 7.89109 5.99333 6.4896 8.05741 14.1618 14.1119 6.70283 5.49936 7.65448 8.25411 8.67331 numMergedOcc 0
58 mol 175 unq 0 iso 0 dist 9.0018 6.57069 8.16421 9.8589 8.22779 7.5414 7.42466 7.652 10.2623 7.24908 5.6234 6.2715 5.35493 10.5631 9.92231 numMergedOcc 0
59 mol 175 unq 1 iso 0 dist 7.652 9.92231 6.2715 7.24908 8.22779 10.5631 7.42466 9.0018 5.6234 9.8589 10.2623 8.16421 5.35493 7.5414 6.57069 numMergedOcc 0
60 mol 175 unq 2 iso 0 dist 5.6234 6.57069 5.35493 9.8589 10.5631 7.5414 7.42466 9.92231 10.2623 7.24908 9.0018 6.2715 8.16421 8.22779 7.652 numMergedOcc 0
61 mol 175 unq 3 iso 0 dist 9.92231 7.652 6.2715 7.24908 10.5631 8.22779 7.42466 5.6234 9.0018 9.8589 10.2623 5.35493 8.16421 7.5414 6.57069 numMergedOcc 0
62 mol 181 unq 0 iso 0 dist 5.98885 9.09537 10.1912 7.20046 5.4601 6.14208 8.88798 9.1374 15.0228 10.2276 10.7062 13.2049 12.8522 10.7112 8.03334 numMergedOcc 0
63 mol 181 unq 1 iso 0 dist 5.98885 9.09537 10.1912 7.13543 10.0524 5.95965 8.88798 9.1374 15.0228 10.7636 10.7062 13.2049 12.8522 7.07409 8.03334 numMergedOcc 0
64 mol 224 unq 0 iso 0 dist 6.57273 8.95269 4.70378 6.87664 7.12232 7.98696 5.0744 6.60589 9.99123 10.8259 10.103 6.77699 10.9861 12.6949 6.65832 numMergedOcc 0
65 mol 224 unq 1 iso 0 dist 6.57273 8.95269 4.70378 6.87664 7.12232 7.98696 5.0744 6.60589 9.99123 10.8259 5.78342 8.49799 11.5372 5.3621 9.16166 numMergedOcc 0
66 mol 224 unq 2 iso 0 dist 6.57273 5.78342 8.49799 6.87664 7.12232 5.3621 5.0744 6.60589 9.16166 10.8259 10.103 6.77699 11.328 12.6949 6.65832 numMergedOcc 0
67 mol 224 unq 3 iso 0 dist 6.57273 6.60589 5.0744 6.65984 5.29877 6.12232 8.49799 5.78342 9.16166 10.667 10.5128 5.60236 6.91102 10.449 5.81334 numMergedOcc 0
68 mol 224 unq 4 iso 0 dist 6.60589 6.57273 5.0744 6.65984 6.12232 5.29877 8.49799 9.16166 5.78342 10.667 10.5128 6.91102 5.60236 10.449 5.81334 numMergedOcc 0
69 mol 224 unq 5 iso 0 dist 5.78342 8.95269 11.5372 6.87664 5.3621 7.98696 5.0744 9.16166 9.99123 10.8259 10.103 11.328 10.9861 12.6949 6.65832 numMergedOcc 0
70 mol 224 unq 6 iso 0 dist 5.78342 8.95269 11.5372 6.87664 5.3621 7.98696 5.0744 9.16166 9.99123 10.8259 6.57273 8.49799 4.70378 7.12232 6.60589 numMergedOcc 0
71 mol 224 unq 7 iso 0 dist 5.78342 6.57273 8.49799 6.87664 5.3621 7.12232 5.0744 9.16166 6.60589 10.8259 10.103 11.328 6.77699 12.6949 6.65832 numMergedOcc 0
72 mol 234 unq 0 iso 0 dist 6.56247 8.34494 6.29886 6.25105 11.216 10.3337 5.88703 9.45496 12.9605 7.85175 9.36357 7.82322 12.1694 11.4315 6.7625 numMergedOcc 0
73 mol 234 unq 1 iso 0 dist 9.36357 8.34494 12.1694 6.25105 11.4315 10.3337 5.88703 6.7625 12.9605 7.85175 6.56247 7.82322 6.29886 11.216 9.45496 numMergedOcc 0
74 mol 234 unq 2 iso 0 dist 9.45496 6.7625 7.82322 9.5707 15.9563 14.4106 5.88703 6.56247 9.36357 10.3388 12.9605 6.29886 12.1694 15.6589 8.34494 numMergedOcc 0
75 mol 234 unq 3 iso 0 dist 9.45496 6.7625 7.82322 7.85175 11.216 11.4315 5.88703 6.56247 9.36357 6.25105 12.9605 6.29886 12.1694 10.3337 8.34494 numMergedOcc 0
76 mol 234 unq 4 iso 0 dist 6.7625 9.45496 7.82322 9.5707 14.4106 15.9563 5.88703 9.36357 6.56247 10.3388 12.9605 12.1694 6.29886 15.6589 8.34494 numMergedOcc 0
77 mol 234 unq 5 iso 0 dist 6.7625 9.45496 7.82322 7.85175 11.4315 11.216 5.88703 9.36357 6.56247 6.25105 12.9605 12.1694 6.29886 10.3337 8.34494 numMergedOcc 0
78 mol 236 unq 0 iso 0 dist 8.03456 6.84306 5.79505 7.17676 11.8759 11.3552 7.28249 9.81562 7.68742 5.34718 9.99038 9.90963 11.3368 6.04825 6.27581 numMergedOcc 0
79 mol 236 unq 1 iso 0 dist 8.03456 6.84306 5.79505 6.68463 9.07822 11.6837 7.28249 9.81562 7.68742 10.5713 9.99038 9.90963 11.3368 8.8265 6.27581 numMergedOcc 0
80 mol 236 unq 2 iso 0 dist 8.03456 9.99038 9.90963 7.17676 11.8759 6.04825 7.28249 9.81562 6.27581 5.34718 6.84306 5.79505 11.3368 11.3552 7.68742 numMergedOcc 0
81 mol 236 unq 3 iso 0 dist 8.03456 9.99038 9.90963 6.68463 9.07822 8.8265 7.28249 9.81562 6.27581 10.5713 6.84306 5.79505 11.3368 11.6837 7.68742 numMergedOcc 0
82 mol 236 unq 4 iso 0 dist 8.03456 9.78037 6.96005 7.17676 11.8759 12.6468 7.28249 9.81562 13.499 5.34718 6.84306 5.79505 11.8739 11.3552 7.68742 numMergedOcc 0
83 mol 236 unq 5 iso 0 dist 8.03456 9.78037 6.96005 7.17676 11.8759 12.6468 7.28249 9.81562 13.499 5.34718 9.99038 9.90963 11.1557 6.04825 6.27581 numMergedOcc 0
84 mol 236 unq 6 iso 0 dist 8.03456 9.78037 6.96005 6.68463 9.07822 5.80136 7.28249 9.81562 13.499 10.5713 6.84306 5.79505 11.8739 11.6837 7.68742 numMergedOcc 0
85 mol 236 unq 7 iso 0 dist 8.03456 9.78037 6.96005 6.68463 9.07822 5.80136 7.28249 9.81562 13.499 10.5713 9.99038 9.90963 11.1557 8.8265 6.27581 numMergedOcc 0
86 mol 236 unq 8 iso 0 dist 8.03456 8.35971 14.2337 7.17676 11.8759 6.40312 7.28249 9.81562 11.2141 5.34718 6.84306 5.79505 14.7998 11.3552 7.68742 numMergedOcc 0
87 mol 236 unq 9 iso 0 dist 8.03456 8.35971 14.2337 7.17676 11.8759 6.40312 7.28249 9.81562 11.2141 5.34718 9.99038 9.90963 10.7497 6.04825 6.27581 numMergedOcc 0
88 mol 236 unq 10 iso 0 dist 8.03456 8.35971 14.2337 6.68463 9.07822 6.2568 7.28249 9.81562 11.2141 10.5713 6.84306 5.79505 14.7998 11.6837 7.68742 numMergedOcc 0
89 mol 236 unq 11 iso 0 dist 8.03456 8.35971 14.2337 6.68463 9.07822 6.2568 7.28249 9.81562 11.2141 10.5713 9.99038 9.90963 10.7497 8.8265 6.27581 numMergedOcc 0
90 mol 236 unq 12 iso 0 dist 6.84306 8.03456 5.79505 7.17676 11.3552 11.8759 7.28249 7.68742 9.81562 5.34718 9.99038 11.3368 9.90963 6.04825 6.27581 numMergedOcc 0
91 mol 236 unq 13 iso 0 dist 6.84306 8.03456 5.79505 6.68463 11.6837 9.07822 7.28249 7.68742 9.81562 10.5713 9.99038 11.3368 9.90963 8.8265 6.27581 numMergedOcc 0
92 mol 236 unq 14 iso 0 dist 6.84306 9.99038 11.3368 7.17676 11.3552 6.04825 7.28249 7.68742 6.27581 5.34718 8.03456 5.79505 9.90963 11.8759 9.81562 numMergedOcc 0
93 mol 236 unq 15 iso 0 dist 6.84306 9.99038 11.3368 6.68463 11.6837 8.8265 7.28249 7.68742 6.27581 10.5713 8.03456 5.79505 9.90963 9.07822 9.81562 numMergedOcc 0
94 mol 236 unq 16 iso 0 dist 6.84306 9.78037 11.8739 7.17676 11.3552 12.6468 7.28249 7.68742 13.499 5.34718 8.03456 5.79505 6.96005 11.8759 9.81562 numMergedOcc 0
95 mol 236 unq 17 iso 0 dist 6.84306 9.78037 11.8739 7.17676 11.3552 12.6468 7.28249 7.68742 13.499 5.34718 9.99038 11.3368 11.1557 6.04825 6.27581 numMergedOcc 0
96 mol 236 unq 18 iso 0 dist 6.84306 9.78037 11.8739 6.68463 11.6837 5.80136 7.28249 7.68742 13.499 10.5713 8.03456 5.79505 6.96005 9.07822 9.81562 numMergedOcc 0
97 mol 236 unq 19 iso 0 dist 6.84306 9.78037 11.8739 6.68463 11.6837 5.80136 7.28249 7.68742 13.499 10.5713 9.99038 11.3368 11.1557 8.8265 6.27581 numMergedOcc 0
98 mol 236 unq 20 iso 0 dist 6.84306 8.35971 14.7998 7.17676 11.3552 6.40312 7.28249 7.68742 11.2141 5.34718 8.03456 5.79505 14.2337 11.8759 9.81562 numMergedOcc 0
99 mol 236 unq 21 iso 0 dist 6.84306 8.35971 14.7998 7.17676 11.3552 6.40312 7.28249 7.68742 11.2141 5.34718 9.99038 11.3368 10.7497 6.04825 6.27581 numMergedOcc 0
100 mol 236 unq 22 iso 0 dist 6.84306 8.35971 14.7998 6.68463 11.6837 6.2568 7.28249 7.68742 11.2141 10.5713 8.03456 5.79505 14.2337 9.07822 9.81562 numMergedOcc 0
101 mol 236 unq 23 iso 0 dist 6.84306 8.35971 14.7998 6.68463 11.6837 6.2568 7.28249 7.68742 11.2141 10.5713 9.99038 11.3368 10.7497 8.8265 6.27581 numMergedOcc 0
102 mol 236 unq 24 iso 0 dist 9.99038 8.03456 9.90963 7.17676 6.04825 11.8759 7.28249 6.27581 9.81562 5.34718 6.84306 11.3368 5.79505 11.3552 7.68742 numMergedOcc 0
103 mol 236 unq 25 iso 0 dist 9.99038 8.03456 9.90963 6.68463 8.8265 9.07822 7.28249 6.27581 9.81562 10.5713 6.84306 11.3368 5.79505 11.6837 7.68742 numMergedOcc 0
104 mol 236 unq 26 iso 0 dist 9.99038 6.84306 11.3368 7.17676 6.04825 11.3552 7.28249 6.27581 7.68742 5.34718 8.03456 9.90963 5.79505 11.8759 9.81562 numMergedOcc 0
105 mol 236 unq 27 iso 0 dist 9.99038 6.84306 11.3368 6.68463 8.8265 11.6837 7.28249 6.27581 7.68742 10.5713 8.03456 9.90963 5.79505 9.07822 9.81562 numMergedOcc 0
106 mol 236 unq 28 iso 0 dist 9.99038 9.78037 11.1557 7.17676 6.04825 12.6468 7.28249 6.27581 13.499 5.34718 8.03456 9.90963 6.96005 11.8759 9.81562 numMergedOcc 0
107 mol 236 unq 29 iso 0 dist 9.99038 9.78037 11.1557 7.17676 6.04825 12.6468 7.28249 6.27581 13.499 5.34718 6.84306 11.3368 11.8739 11.3552 7.68742 numMergedOcc 0
108 mol 236 unq 30 iso 0 dist 9.99038 9.78037 11.1557 6.68463 8.8265 5.80136 7.28249 6.27581 13.499 10.5713 8.03456 9.90963 6.96005 9.07822 9.81562 numMergedOcc 0
109 mol 236 unq 31 iso 0 dist 9.99038 9.78037 11.1557 6.68463 8.8265 5.80136 7.28249 6.27581 13.499 10.5713 6.84306 11.3368 11.8739 11.6837 7.68742 numMergedOcc 0
110 mol 236 unq 32 iso 0 dist 9.99038 8.35971 10.7497 7.17676 6.04825 6.40312 7.28249 6.27581 11.2141 5.34718 8.03456 9.90963 14.2337 11.8759 9.81562 numMergedOcc 0
111 mol 236 unq 33 iso 0 dist 9.99038 8.35971 10.7497 7.17676 6.04825 6.40312 7.28249 6.27581 11.2141 5.34718 6.84306 11.3368 14.7998 11.3552 7.68742 numMergedOcc 0
112 mol 236 unq 34 iso 0 dist 9.99038 8.35971 10.7497 6.68463 8.8265 6.2568 7.28249 6.27581 11.2141 10.5713 8.03456 9.90963 14.2337 9.07822 9.81562 numMergedOcc 0
113 mol 236 unq 35 iso 0 dist 9.99038 8.35971 10.7497 6.68463 8.8265 6.2568 7.28249 6.27581 11.2141 10.5713 6.84306 11.3368 14.7998 11.6837 7.68742 numMergedOcc 0
114 mol 236 unq 36 iso 0 dist 9.81562 7.68742 5.79505 5.34718 11.8759 11.3552 7.28249 8.03456 6.84306 7.17676 6.27581 9.90963 11.3368 6.04825 9.99038 numMergedOcc 0
115 mol 236 unq 37 iso 0 dist 9.81562 7.68742 5.79505 5.34718 11.8759 11.3552 7.28249 8.03456 6.84306 7.17676 13.499 6.96005 11.8739 12.6468 9.78037 numMergedOcc 0
116 mol 236 unq 38 iso 0 dist 9.81562 7.68742 5.79505 5.34718 11.8759 11.3552 7.28249 8.03456 6.84306 7.17676 11.2141 14.2337 14.7998 6.40312 8.35971 numMergedOcc 0
117 mol 236 unq 39 iso 0 dist 9.81562 6.27581 9.90963 5.34718 11.8759 6.04825 7.28249 8.03456 9.99038 7.17676 7.68742 5.79505 11.3368 11.3552 6.84306 numMergedOcc 0
118 mol 236 unq 40 iso 0 dist 9.81562 6.27581 9.90963 5.34718 11.8759 6.04825 7.28249 8.03456 9.99038 7.17676 13.499 6.96005 11.1557 12.6468 9.78037 numMergedOcc 0
119 mol 236 unq 41 iso 0 dist 9.81562 6.27581 9.90963 5.34718 11.8759 6.04825 7.28249 8.03456 9.99038 7.17676 11.2141 14.2337 10.7497 6.40312 8.35971 numMergedOcc 0
120 mol 236 unq 42 iso 0 dist 7.68742 9.81562 5.79505 5.34718 11.3552 11.8759 7.28249 6.84306 8.03456 7.17676 6.27581 11.3368 9.90963 6.04825 9.99038 numMergedOcc 0
121 mol 236 unq 43 iso 0 dist 7.68742 9.81562 5.79505 5.34718 11.3552 11.8759 7.28249 6.84306 8.03456 7.17676 13.499 11.8739 6.96005 12.6468 9.78037 numMergedOcc 0
122 mol 236 unq 44 iso 0 dist 7.68742 9.81562 5.79505 5.34718 11.3552 11.8759 7.28249 6.84306 8.03456 7.17676 11.2141 14.7998 14.2337 6.40312 8.35971 numMergedOcc 0
123 mol 236 unq 45 iso 0 dist 7.68742 6.27581 11.3368 5.34718 11.3552 6.04825 7.28249 6.84306 9.99038 7.17676 9.81562 5.79505 9.90963 11.8759 8.03456 numMergedOcc 0
124 mol 236 unq 46 iso 0 dist 7.68742 6.27581 11.3368 5.34718 11.3552 6.04825 7.28249 6.84306 9.99038 7.17676 13.499 11.8739 11.1557 12.6468 9.78037 numMergedOcc 0
125 mol 236 unq 47 iso 0 dist 7.68742 6.27581 11.3368 5.34718 11.3552 6.04825 7.28249 6.84306 9.99038 7.17676 11.2141 14.7998 10.7497 6.40312 8.35971 numMergedOcc 0
126 mol 236 unq 48 iso 0 dist 6.27581 9.81562 9.90963 5.34718 6.04825 11.8759 7.28249 9.99038 8.03456 7.17676 7.68742 11.3368 5.79505 11.3552 6.84306 numMergedOcc 0
127 mol 236 unq 49 iso 0 dist 6.27581 9.81562 9.90963 5.34718 6.04825 11.8759 7.28249 9.99038 8.03456 7.17676 13.499 11.1557 6.96005 12.6468 9.78037 numMergedOcc 0
128 mol 236 unq 50 iso 0 dist 6.27581 9.81562 9.90963 5.34718 6.04825 11.8759 7.28249 9.99038 8.03456 7.17676 11.2141 10.7497 14.2337 6.40312 8.35971 numMergedOcc 0
129 mol 236 unq 51 iso 0 dist 6.27581 7.68742 11.3368 5.34718 6.04825 11.3552 7.28249 9.99038 6.84306 7.17676 9.81562 9.90963 5.79505 11.8759 8.03456 numMergedOcc 0
130 mol 236 unq 52 iso 0 dist 6.27581 7.68742 11.3368 5.34718 6.04825 11.3552 7.28249 9.99038 6.84306 7.17676 13.499 11.1557 11.8739 12.6468 9.78037 numMergedOcc 0
131 mol 236 unq 53 iso 0 dist 6.27581 7.68742 11.3368 5.34718 6.04825 11.3552 7.28249 9.99038 6.84306 7.17676 11.2141 10.7497 14.7998 6.40312 8.35971 numMergedOcc 0
132 mol 259 unq 0 iso 0 dist 7.88519 7.84554 4.86771 7.48005 11.6195 11.8736 4.69778 8.13497 9.95973 10.9591 10.5767 10.582 10.4756 17.9331 8.53687 numMergedOcc 0
133 mol 259 unq 1 iso 0 dist 7.88519 7.46176 6.96053 7.48005 11.6195 5.79468 4.69778 8.13497 10.3935 10.9591 10.5767 10.582 15.7715 17.9331 8.53687 numMergedOcc 0
134 mol 259 unq 2 iso 0 dist 7.88519 9.18903 10.4881 7.48005 11.6195 12.6649 4.69778 8.13497 12.6839 10.9591 10.5767 10.582 12.5247 17.9331 8.53687 numMergedOcc 0
