0 mol 19 unq 0 iso 0 dist 7.20519 8.23643 11.0832 6.92532 12.3486 6.87842 5.03957 12.1187 8.73972 6.36455 4.54938 7.34551 6.55187 5.18512 7.82074 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 7.20519 7.82528 10.4988 6.92532 12.3486 6.34272 7.67038 10.4091 6.20943 10.1882 4.54938 7.34551 5.14627 5.18512 8.4674 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 7.20519 7.82528 10.4988 6.92532 12.3486 6.34272 7.67038 10.4091 6.20943 10.1882 6.864 7.07775 4.69858 9.47529 4.51865 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 4.54938 7.82528 5.14627 6.92532 5.18512 6.34272 7.67038 8.4674 6.20943 10.1882 6.864 5.80928 4.69858 9.47529 4.51865 numMergedOcc 0
4 mol 19 unq 4 iso 0 dist 7.82074 8.73972 6.55187 6.36455 5.18512 6.87842 5.03957 4.54938 8.23643 6.92532 12.1187 7.34551 11.0832 12.3486 7.20519 numMergedOcc 0
5 mol 19 unq 5 iso 0 dist 7.82074 8.73972 6.55187 6.36455 5.18512 6.87842 5.03957 4.54938 8.23643 6.92532 11.0366 5.80928 12.3093 9.47529 6.864 numMergedOcc 0
6 mol 19 unq 6 iso 0 dist 6.864 8.23643 12.3093 6.92532 9.47529 6.87842 5.03957 11.0366 8.73972 6.36455 4.54938 5.80928 6.55187 5.18512 7.82074 numMergedOcc 0
7 mol 19 unq 7 iso 0 dist 6.864 7.82528 4.69858 6.92532 9.47529 6.34272 7.67038 4.51865 6.20943 10.1882 4.54938 5.80928 5.14627 5.18512 8.4674 numMergedOcc 0
8 mol 45 unq 0 iso 0 dist 6.43774 7.06308 4.71384 6.06454 5.73693 5.94047 5.24762 7.2846 6.34173 9.44459 11.2563 8.81358 5.67689 11.6164 7.58835 numMergedOcc 0
9 mol 45 unq 1 iso 0 dist 7.58835 6.34173 5.67689 9.44459 11.6164 5.94047 5.24762 11.2563 7.06308 6.06454 7.2846 8.81358 4.71384 5.73693 6.43774 numMergedOcc 0
10 mol 58 unq 0 iso 0 dist 6.64012 6.46761 5.24906 7.27383 6.37648 9.17656 10.8153 13.497 8.63333 14.62 10.3224 9.94737 6.47744 10.4524 6.86465 numMergedOcc 0
11 mol 58 unq 1 iso 0 dist 6.64012 6.46761 5.24906 7.27383 6.37648 9.17656 8.62958 12.1902 8.89374 10.9864 10.3224 9.94737 6.47744 10.4524 6.35756 numMergedOcc 0
12 mol 58 unq 2 iso 0 dist 6.64012 6.46761 5.24906 7.27383 6.37648 9.17656 6.47414 9.4099 9.73139 12.5444 13.4544 10.6169 13.1021 15.935 9.55426 numMergedOcc 0
13 mol 58 unq 3 iso 0 dist 6.64012 7.58407 5.11205 7.27383 6.37648 10.8775 11.0466 11.396 6.40841 16.5117 13.4544 10.6169 6.75888 15.935 7.32874 numMergedOcc 0
14 mol 58 unq 4 iso 0 dist 6.64012 7.58407 5.11205 7.27383 6.37648 10.8775 6.47414 9.4099 6.31428 12.5444 13.4544 10.6169 6.75888 15.935 9.55426 numMergedOcc 0
15 mol 73 unq 0 iso 0 dist 9.38498 8.70133 13.4082 7.04044 15.7304 11.2505 7.4697 8.9232 5.64598 13.1821 13.1662 11.8291 9.77992 18.9907 5.93252 numMergedOcc 0
16 mol 73 unq 1 iso 0 dist 9.38498 8.70133 13.4082 7.04044 15.7304 11.2505 5.4148 10.2049 4.65521 8.73253 9.96396 15.7123 7.41074 8.26458 6.19304 numMergedOcc 0
17 mol 73 unq 2 iso 0 dist 9.96396 8.70133 7.41074 7.04044 8.26458 11.2505 7.4697 11.4799 5.64598 13.1821 13.1662 16.5689 9.77992 18.9907 5.93252 numMergedOcc 0
18 mol 73 unq 3 iso 0 dist 6.19304 4.65521 7.41074 8.73253 8.26458 11.2505 5.4148 9.96396 8.70133 7.04044 10.2049 15.7123 13.4082 15.7304 9.38498 numMergedOcc 0
19 mol 73 unq 4 iso 0 dist 6.19304 4.65521 7.41074 8.73253 8.26458 11.2505 5.4148 9.96396 8.70133 7.04044 11.6369 12.016 15.9882 8.35241 9.75218 numMergedOcc 0
20 mol 73 unq 5 iso 0 dist 6.19304 4.65521 7.41074 8.73253 8.26458 11.2505 5.7113 11.4799 5.64598 13.1821 11.379 16.5689 9.77992 18.9907 5.93252 numMergedOcc 0
21 mol 73 unq 6 iso 0 dist 9.75218 8.70133 15.9882 7.04044 8.35241 11.2505 7.4697 16.0453 5.64598 13.1821 13.1662 21.7714 9.77992 18.9907 5.93252 numMergedOcc 0
22 mol 73 unq 7 iso 0 dist 9.75218 8.70133 15.9882 7.04044 8.35241 11.2505 5.4148 11.6369 4.65521 8.73253 9.96396 12.016 7.41074 8.26458 6.19304 numMergedOcc 0
23 mol 85 unq 0 iso 0 dist 7.97049 9.47876 7.98917 7.1589 6.37974 12.5072 6.9948 7.47541 7.22293 11.2808 6.19965 5.42586 11.6116 5.08358 7.66905 numMergedOcc 0
24 mol 85 unq 1 iso 0 dist 7.97049 9.47876 7.98917 7.1589 6.37974 12.5072 6.9948 7.47541 7.22293 11.2808 11.2656 6.87425 6.47779 12.9551 5.73196 numMergedOcc 0
25 mol 85 unq 2 iso 0 dist 6.19965 9.47876 11.6116 7.1589 5.08358 12.5072 6.9948 7.66905 7.22293 11.2808 7.97049 5.42586 7.98917 6.37974 7.47541 numMergedOcc 0
26 mol 85 unq 3 iso 0 dist 6.19965 9.47876 11.6116 7.1589 5.08358 12.5072 6.9948 7.66905 7.22293 11.2808 11.2656 10.1164 6.47779 12.9551 5.73196 numMergedOcc 0
27 mol 114 unq 0 iso 0 dist 7.5732 8.71128 5.80557 6.34525 11.128 14.3491 5.59517 10.1027 7.52743 11.6441 10.1937 8.94198 4.77056 16.3062 7.35754 numMergedOcc 0
28 mol 115 unq 0 iso 0 dist 7.30858 8.66155 11.3902 5.72642 5.61704 5.87507 7.69052 13.8473 9.66954 10.9734 5.83991 10.8507 6.09023 6.4497 9.33865 numMergedOcc 0
29 mol 115 unq 1 iso 0 dist 7.30858 8.66155 11.3902 5.72642 5.61704 5.87507 7.69052 13.8473 9.66954 10.9734 7.88312 11.5723 4.61908 7.3094 6.11741 numMergedOcc 0
30 mol 115 unq 2 iso 0 dist 5.83991 8.66155 6.09023 5.72642 6.4497 5.87507 7.69052 9.33865 9.66954 10.9734 7.88312 8.02349 4.61908 7.3094 6.11741 numMergedOcc 0
31 mol 115 unq 3 iso 0 dist 7.88312 8.66155 4.61908 5.72642 7.3094 5.87507 7.69052 6.11741 9.66954 10.9734 5.83991 8.02349 6.09023 6.4497 9.33865 numMergedOcc 0
32 mol 119 unq 0 iso 0 dist 8.73993 9.63176 10.6679 7.77116 3.78311 8.96522 12.4603 12.6489 7.44174 13.1741 10.3704 4.85907 7.36192 4.99056 9.87172 numMergedOcc 0
33 mol 134 unq 0 iso 0 dist 6.54501 8.6355 10.1448 5.53031 5.35679 11.9544 8.80819 11.9139 8.79571 13.9396 6.49416 5.00526 5.41704 8.46636 8.94367 numMergedOcc 0
34 mol 134 unq 1 iso 0 dist 6.54501 8.6355 10.1448 5.53031 5.35679 11.9544 8.80819 11.9139 8.79571 13.9396 12.5075 11.3271 6.17103 15.2647 9.86662 numMergedOcc 0
35 mol 134 unq 2 iso 0 dist 6.54501 8.6355 10.1448 5.53031 5.35679 11.9544 5.00817 9.5126 5.42582 10.1537 6.49416 5.00526 5.41704 8.46636 6.37586 numMergedOcc 0
36 mol 134 unq 3 iso 0 dist 6.54501 8.6355 10.1448 5.53031 5.35679 11.9544 5.00817 9.5126 5.42582 10.1537 12.5075 11.3271 6.17103 15.2647 9.71307 numMergedOcc 0
37 mol 134 unq 4 iso 0 dist 8.94367 8.79571 5.41704 8.20836 9.4027 9.65798 5.49782 6.37586 5.42582 10.873 9.86662 6.81259 6.17103 5.12325 9.71307 numMergedOcc 0
38 mol 134 unq 5 iso 0 dist 8.94367 8.79571 5.41704 8.20836 9.4027 9.65798 8.80819 6.49416 8.6355 13.846 11.9139 5.00526 10.1448 13.1292 6.54501 numMergedOcc 0
39 mol 134 unq 6 iso 0 dist 6.49416 8.6355 5.41704 5.53031 8.46636 11.9544 8.80819 8.94367 8.79571 13.9396 12.5075 6.81259 6.17103 15.2647 9.86662 numMergedOcc 0
40 mol 134 unq 7 iso 0 dist 6.49416 8.6355 5.41704 5.53031 8.46636 11.9544 5.00817 6.37586 5.42582 10.1537 12.5075 6.81259 6.17103 15.2647 9.71307 numMergedOcc 0
41 mol 134 unq 8 iso 0 dist 9.86662 8.79571 6.17103 8.20836 5.12325 9.65798 5.49782 9.71307 5.42582 10.873 8.94367 6.81259 5.41704 9.4027 6.37586 numMergedOcc 0
42 mol 134 unq 9 iso 0 dist 9.86662 8.79571 6.17103 8.20836 5.12325 9.65798 8.80819 12.5075 8.6355 13.846 11.9139 11.3271 10.1448 13.1292 6.54501 numMergedOcc 0
43 mol 134 unq 10 iso 0 dist 9.86662 8.79571 6.17103 8.20836 5.12325 9.65798 8.80819 12.5075 8.6355 13.846 8.94367 6.81259 5.41704 9.4027 6.49416 numMergedOcc 0
44 mol 142 unq 0 iso 0 dist 9.2313 7.15475 9.49653 9.17106 12.6057 5.14959 5.32922 5.31024 9.07935 12.432 7.73169 5.50998 7.53854 8.38032 7.26382 numMergedOcc 0
45 mol 142 unq 1 iso 0 dist 7.73169 7.15475 7.53854 9.17106 8.38032 5.14959 5.32922 7.26382 9.07935 12.432 9.2313 5.50998 9.49653 12.6057 5.31024 numMergedOcc 0
46 mol 142 unq 2 iso 0 dist 8.96657 7.15475 10.3477 9.17106 8.16815 5.14959 5.32922 11.0824 9.07935 12.432 9.2313 11.1395 9.49653 12.6057 5.31024 numMergedOcc 0
47 mol 142 unq 3 iso 0 dist 8.96657 7.15475 10.3477 9.17106 8.16815 5.14959 5.32922 11.0824 9.07935 12.432 7.73169 5.92693 7.53854 8.38032 7.26382 numMergedOcc 0
48 mol 227 unq 0 iso 0 dist 8.65997 6.95902 6.43754 5.4694 11.0628 5.92529 5.22356 7.22101 8.17891 8.38865 10.8157 4.39704 9.13836 12.9587 7.09863 numMergedOcc 0
49 mol 227 unq 1 iso 0 dist 7.09863 8.17891 9.13836 8.38865 12.9587 5.92529 5.22356 10.8157 6.95902 5.4694 7.22101 4.39704 6.43754 11.0628 8.65997 numMergedOcc 0
50 mol 234 unq 0 iso 0 dist 8.34494 6.25105 10.3337 8.24186 11.7705 13.0974 5.88703 12.9605 7.85175 7.5366 6.56247 6.29886 11.216 5.63086 9.45496 numMergedOcc 0
51 mol 234 unq 1 iso 0 dist 8.34494 6.25105 10.3337 8.24186 11.7705 13.0974 5.88703 12.9605 7.85175 7.5366 9.36357 12.1694 11.4315 5.6819 6.7625 numMergedOcc 0
52 mol 234 unq 2 iso 0 dist 6.56247 6.25105 11.216 8.24186 5.63086 13.0974 5.88703 9.45496 7.85175 7.5366 9.36357 7.82322 11.4315 5.6819 6.7625 numMergedOcc 0
53 mol 234 unq 3 iso 0 dist 9.36357 6.25105 11.4315 8.24186 5.6819 13.0974 5.88703 6.7625 7.85175 7.5366 6.56247 7.82322 11.216 5.63086 9.45496 numMergedOcc 0
54 mol 234 unq 4 iso 0 dist 9.45496 7.85175 11.216 7.5366 5.63086 13.0974 5.88703 6.56247 6.25105 8.24186 12.9605 6.29886 10.3337 11.7705 8.34494 numMergedOcc 0
55 mol 234 unq 5 iso 0 dist 9.45496 7.85175 11.216 7.5366 5.63086 13.0974 5.88703 6.56247 6.25105 8.24186 6.7625 7.82322 11.4315 5.6819 9.36357 numMergedOcc 0
56 mol 234 unq 6 iso 0 dist 6.7625 7.85175 11.4315 7.5366 5.6819 13.0974 5.88703 9.36357 6.25105 8.24186 12.9605 12.1694 10.3337 11.7705 8.34494 numMergedOcc 0
57 mol 234 unq 7 iso 0 dist 6.7625 7.85175 11.4315 7.5366 5.6819 13.0974 5.88703 9.36357 6.25105 8.24186 9.45496 7.82322 11.216 5.63086 6.56247 numMergedOcc 0
58 mol 236 unq 0 iso 0 dist 9.81562 5.34718 11.8759 8.50331 7.22918 11.6774 7.28249 8.03456 7.17676 11.9847 7.68742 5.79505 11.3552 9.05842 6.84306 numMergedOcc 0
59 mol 236 unq 1 iso 0 dist 9.81562 5.34718 11.8759 8.50331 7.22918 11.6774 7.28249 8.03456 7.17676 11.9847 6.27581 9.90963 6.04825 7.00028 9.99038 numMergedOcc 0
60 mol 236 unq 2 iso 0 dist 9.81562 5.34718 11.8759 8.50331 7.22918 11.6774 7.28249 8.03456 7.17676 11.9847 13.499 6.96005 12.6468 11.7392 9.78037 numMergedOcc 0
61 mol 236 unq 3 iso 0 dist 9.81562 5.34718 11.8759 8.50331 7.22918 11.6774 7.28249 8.03456 7.17676 11.9847 11.2141 14.2337 6.40312 16.3568 8.35971 numMergedOcc 0
62 mol 236 unq 4 iso 0 dist 7.68742 5.34718 11.3552 8.50331 9.05842 11.6774 7.28249 6.84306 7.17676 11.9847 9.81562 5.79505 11.8759 7.22918 8.03456 numMergedOcc 0
63 mol 236 unq 5 iso 0 dist 7.68742 5.34718 11.3552 8.50331 9.05842 11.6774 7.28249 6.84306 7.17676 11.9847 6.27581 11.3368 6.04825 7.00028 9.99038 numMergedOcc 0
64 mol 236 unq 6 iso 0 dist 7.68742 5.34718 11.3552 8.50331 9.05842 11.6774 7.28249 6.84306 7.17676 11.9847 13.499 11.8739 12.6468 11.7392 9.78037 numMergedOcc 0
65 mol 236 unq 7 iso 0 dist 7.68742 5.34718 11.3552 8.50331 9.05842 11.6774 7.28249 6.84306 7.17676 11.9847 11.2141 14.7998 6.40312 16.3568 8.35971 numMergedOcc 0
66 mol 236 unq 8 iso 0 dist 6.27581 5.34718 6.04825 8.50331 7.00028 11.6774 7.28249 9.99038 7.17676 11.9847 9.81562 9.90963 11.8759 7.22918 8.03456 numMergedOcc 0
67 mol 236 unq 9 iso 0 dist 6.27581 5.34718 6.04825 8.50331 7.00028 11.6774 7.28249 9.99038 7.17676 11.9847 7.68742 11.3368 11.3552 9.05842 6.84306 numMergedOcc 0
68 mol 236 unq 10 iso 0 dist 6.27581 5.34718 6.04825 8.50331 7.00028 11.6774 7.28249 9.99038 7.17676 11.9847 13.499 11.1557 12.6468 11.7392 9.78037 numMergedOcc 0
69 mol 236 unq 11 iso 0 dist 6.27581 5.34718 6.04825 8.50331 7.00028 11.6774 7.28249 9.99038 7.17676 11.9847 11.2141 10.7497 6.40312 16.3568 8.35971 numMergedOcc 0
70 mol 272 unq 0 iso 0 dist 9.97651 9.09992 10.841 9.19033 10.26 11.8912 5.40809 13.2494 6.73206 11.9971 8.46116 8.12676 5.63139 13.5034 8.33638 numMergedOcc 0
