0 mol 5 unq 0 iso 0 dist 9.38842 7.15734 6.343 8.88048 14.328 13.8842 6.77563 8.08754 5.32128 9.72215 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 9.95422 9.00925 15.0835 8.68949 7.19549 16.2669 8.89145 12.7683 5.7343 13.2274 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 9.95422 9.00925 15.0835 8.68949 7.19549 16.2669 6.92865 12.3778 11.3728 8.33226 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 7.65219 9.00925 15.5539 8.68949 4.77791 16.2669 8.89145 13.0138 5.7343 13.2274 numMergedOcc 0
4 mol 8 unq 3 iso 0 dist 7.65219 9.00925 15.5539 8.68949 4.77791 16.2669 6.92865 5.95251 11.3728 8.33226 numMergedOcc 0
5 mol 12 unq 0 iso 0 dist 9.99955 5.9021 14.5243 6.6051 11.9718 4.86727 8.17618 10.8817 7.58748 6.67154 numMergedOcc 0
6 mol 12 unq 1 iso 0 dist 9.99955 8.98466 5.3482 6.6051 11.9718 10.763 8.17618 10.8817 6.89226 6.67154 numMergedOcc 0
7 mol 19 unq 0 iso 0 dist 6.8824 9.3147 5.83115 8.75001 4.51869 10.2713 7.78708 5.3957 9.38012 5.18509 numMergedOcc 0
8 mol 19 unq 1 iso 0 dist 6.8824 9.3147 5.83115 8.75001 4.51869 10.2713 7.84393 10.38 10.5285 12.48 numMergedOcc 0
9 mol 19 unq 2 iso 0 dist 6.8824 9.79426 13.3381 8.75001 4.51869 12.053 7.78708 5.3957 9.55318 5.18509 numMergedOcc 0
10 mol 19 unq 3 iso 0 dist 6.8824 9.79426 13.3381 8.75001 4.51869 12.053 7.84393 10.38 9.84922 12.48 numMergedOcc 0
11 mol 19 unq 4 iso 0 dist 8.33492 9.3147 15.1867 8.75001 14.2304 10.2713 7.78708 10.6828 9.38012 5.18509 numMergedOcc 0
12 mol 19 unq 5 iso 0 dist 8.33492 9.3147 15.1867 8.75001 14.2304 10.2713 7.84393 6.01189 10.5285 12.48 numMergedOcc 0
13 mol 19 unq 6 iso 0 dist 8.33492 9.79426 6.1852 8.75001 14.2304 12.053 7.78708 10.6828 9.55318 5.18509 numMergedOcc 0
14 mol 19 unq 7 iso 0 dist 8.33492 9.79426 6.1852 8.75001 14.2304 12.053 7.84393 6.01189 9.84922 12.48 numMergedOcc 0
15 mol 33 unq 0 iso 0 dist 7.99091 8.43688 10.264 8.37901 7.07421 3.80563 5.66319 5.62472 9.42379 7.83082 numMergedOcc 0
16 mol 33 unq 1 iso 0 dist 9.82882 8.43688 6.40736 8.37901 5.3434 3.80563 5.66319 6.77726 9.42379 7.83082 numMergedOcc 0
17 mol 48 unq 0 iso 0 dist 9.65989 8.36915 5.70853 9.53081 17.0289 13.2937 5.36645 10.2391 8.03277 12.299 numMergedOcc 0
18 mol 48 unq 1 iso 0 dist 9.65989 6.01454 11.7008 9.53081 17.0289 5.41488 5.36645 10.2391 9.26483 12.299 numMergedOcc 0
19 mol 48 unq 2 iso 0 dist 8.66272 8.36915 4.8908 9.53081 10.9256 13.2937 5.36645 10.8186 8.03277 12.299 numMergedOcc 0
20 mol 48 unq 3 iso 0 dist 8.66272 6.01454 5.82846 9.53081 10.9256 5.41488 5.36645 10.8186 9.26483 12.299 numMergedOcc 0
21 mol 69 unq 0 iso 0 dist 7.32268 8.36667 8.99315 8.70964 5.09223 11.5923 8.24121 8.0675 14.9981 6.57301 numMergedOcc 0
22 mol 69 unq 1 iso 0 dist 7.32268 8.36667 8.99315 8.70964 5.09223 11.5923 8.52371 12.8766 13.689 10.2661 numMergedOcc 0
23 mol 69 unq 2 iso 0 dist 7.32268 8.36667 8.99315 8.70964 5.09223 11.5923 6.8198 7.98306 5.23597 8.09841 numMergedOcc 0
24 mol 133 unq 0 iso 0 dist 8.54607 9.6582 7.72261 9.23104 7.21249 12.4825 5.97805 7.50335 12.6081 4.80228 numMergedOcc 0
25 mol 133 unq 1 iso 0 dist 8.54607 5.17734 4.27464 9.23104 7.21249 7.75771 5.97805 7.50335 5.26273 4.80228 numMergedOcc 0
26 mol 143 unq 0 iso 0 dist 7.78154 6.68364 4.62682 6.87456 4.58639 7.87375 5.30872 7.64386 5.4432 8.03483 numMergedOcc 0
27 mol 143 unq 1 iso 0 dist 5.9183 6.68364 9.74045 6.87456 7.75087 7.87375 5.30872 5.11989 5.4432 8.03483 numMergedOcc 0
28 mol 186 unq 0 iso 0 dist 5.65146 7.02662 9.21526 6.72718 4.84679 6.12748 6.99623 5.47219 6.3719 5.25279 numMergedOcc 0
29 mol 186 unq 1 iso 0 dist 5.65146 7.02662 9.21526 8.72949 10.0343 8.01622 6.99623 5.47219 6.3719 5.80721 numMergedOcc 0
30 mol 186 unq 2 iso 0 dist 7.87204 9.94142 8.42816 8.46819 5.00539 8.05438 8.93307 8.3331 11.5966 4.37376 numMergedOcc 0
31 mol 217 unq 0 iso 0 dist 9.94746 6.01666 6.28311 7.60302 11.2776 5.16489 9.90668 6.92624 5.42652 8.92136 numMergedOcc 0
32 mol 220 unq 0 iso 0 dist 6.45234 7.35148 9.97963 6.39087 5.9596 11.4142 7.30244 8.70715 10.48 12.2765 numMergedOcc 0
33 mol 220 unq 1 iso 0 dist 6.45234 7.35148 9.97963 6.39087 5.9596 11.4142 7.29796 10.898 5.23846 13.2427 numMergedOcc 0
34 mol 220 unq 2 iso 0 dist 8.37469 7.86207 15.7127 9.89039 13.8056 9.09963 8.9077 16.7786 4.90657 13.6952 numMergedOcc 0
35 mol 220 unq 3 iso 0 dist 8.37469 7.86207 15.7127 8.57174 6.77956 14.3078 8.9077 16.7786 4.90657 13.8822 numMergedOcc 0
36 mol 223 unq 0 iso 0 dist 9.03969 9.29204 12.1037 6.97426 12.4791 4.73988 9.94212 10.6103 18.385 15.9255 numMergedOcc 0
37 mol 223 unq 1 iso 0 dist 9.03969 9.29204 12.1037 6.97426 12.4791 4.73988 7.34316 4.21803 8.16187 8.64175 numMergedOcc 0
38 mol 223 unq 2 iso 0 dist 9.03969 9.29204 12.1037 8.87456 16.4578 8.36102 9.94212 10.6103 18.385 17.7343 numMergedOcc 0
39 mol 223 unq 3 iso 0 dist 9.03969 9.29204 12.1037 8.87456 16.4578 8.36102 7.34316 4.21803 8.16187 12.9895 numMergedOcc 0
40 mol 223 unq 4 iso 0 dist 9.03969 9.14789 14.841 6.97426 12.4791 4.78255 9.94212 10.6103 19.0281 15.9255 numMergedOcc 0
41 mol 223 unq 5 iso 0 dist 9.03969 9.14789 14.841 6.97426 12.4791 4.78255 7.34316 4.21803 11.2364 8.64175 numMergedOcc 0
42 mol 223 unq 6 iso 0 dist 9.03969 9.14789 14.841 8.87456 16.4578 5.43913 9.94212 10.6103 19.0281 17.7343 numMergedOcc 0
43 mol 223 unq 7 iso 0 dist 9.03969 9.14789 14.841 8.87456 16.4578 5.43913 7.34316 4.21803 11.2364 12.9895 numMergedOcc 0
44 mol 223 unq 8 iso 0 dist 9.03969 7.80764 11.4317 6.97426 12.4791 12.6805 9.94212 10.6103 4.67731 15.9255 numMergedOcc 0
45 mol 223 unq 9 iso 0 dist 9.03969 7.80764 11.4317 6.97426 12.4791 12.6805 7.34316 4.21803 11.4951 8.64175 numMergedOcc 0
46 mol 223 unq 10 iso 0 dist 9.03969 7.80764 11.4317 8.87456 16.4578 13.9763 9.94212 10.6103 4.67731 17.7343 numMergedOcc 0
47 mol 223 unq 11 iso 0 dist 9.03969 7.80764 11.4317 8.87456 16.4578 13.9763 7.34316 4.21803 11.4951 12.9895 numMergedOcc 0
48 mol 223 unq 12 iso 0 dist 9.03969 5.75896 4.44076 6.97426 12.4791 10.6184 9.94212 10.6103 7.19485 15.9255 numMergedOcc 0
49 mol 223 unq 13 iso 0 dist 9.03969 5.75896 4.44076 6.97426 12.4791 10.6184 7.34316 4.21803 5.18719 8.64175 numMergedOcc 0
50 mol 223 unq 14 iso 0 dist 9.03969 5.75896 4.44076 8.87456 16.4578 13.8469 9.94212 10.6103 7.19485 17.7343 numMergedOcc 0
51 mol 223 unq 15 iso 0 dist 9.03969 5.75896 4.44076 8.87456 16.4578 13.8469 7.34316 4.21803 5.18719 12.9895 numMergedOcc 0
52 mol 229 unq 0 iso 0 dist 5.22312 8.36396 9.09385 7.48693 4.88762 5.52342 8.0007 6.44004 11.2438 8.75723 numMergedOcc 0
53 mol 276 unq 0 iso 0 dist 9.15041 9.68846 12.7102 9.87655 8.99762 4.97223 8.95876 5.88008 13.702 11.5806 numMergedOcc 0
54 mol 276 unq 1 iso 0 dist 9.15041 9.68846 12.7102 9.87655 8.99762 4.97223 8.259 9.98469 6.21925 6.7181 numMergedOcc 0
