0 mol 7 unq 0 iso 0 dist 5.72491 8.72114 10.1959 11.8172 14.9635 6.02702 6.34041 11.024 6.14469 6.55304 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 7.05346 7.32257 8.88528 6.14147 10.5699 6.55811 8.50424 8.076 7.35972 6.02809 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 7.05346 7.32257 8.88528 10.5747 12.6235 8.64915 8.50424 8.076 7.35972 4.98827 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 7.9944 6.55811 4.58685 6.14147 10.8213 7.32257 6.02809 6.32226 7.35972 8.50424 numMergedOcc 0
4 mol 9 unq 3 iso 0 dist 7.9944 6.55811 4.58685 5.06358 7.032 8.64915 6.02809 6.32226 7.35972 4.98827 numMergedOcc 0
5 mol 9 unq 4 iso 0 dist 7.9944 7.36018 5.83039 5.06358 7.032 8.17347 6.02809 6.32226 9.93542 4.98827 numMergedOcc 0
6 mol 9 unq 5 iso 0 dist 7.032 8.64915 4.58685 10.5747 10.8213 7.32257 4.98827 6.32226 7.35972 8.50424 numMergedOcc 0
7 mol 9 unq 6 iso 0 dist 7.032 8.64915 4.58685 5.06358 7.9944 6.55811 4.98827 6.32226 7.35972 6.02809 numMergedOcc 0
8 mol 9 unq 7 iso 0 dist 7.032 8.17347 5.83039 5.06358 7.9944 7.36018 4.98827 6.32226 9.93542 6.02809 numMergedOcc 0
9 mol 19 unq 0 iso 0 dist 6.92532 7.75618 13.9675 7.67038 10.1882 8.40416 4.97119 6.39966 9.95212 4.64838 numMergedOcc 0
10 mol 24 unq 0 iso 0 dist 6.60423 9.41441 11.9395 11.4989 14.156 6.73939 4.32034 9.69752 8.00171 11.9112 numMergedOcc 0
11 mol 24 unq 1 iso 0 dist 6.60423 9.41441 11.9395 11.4989 14.156 6.73939 12.2662 16.6617 5.95834 6.56748 numMergedOcc 0
12 mol 24 unq 2 iso 0 dist 6.60423 9.41441 11.9395 11.4989 14.156 6.73939 8.67951 12.7806 4.2121 4.50066 numMergedOcc 0
13 mol 24 unq 3 iso 0 dist 6.60423 9.41441 11.9395 11.4989 14.156 6.73939 8.52463 9.36461 6.72323 5.11617 numMergedOcc 0
14 mol 24 unq 4 iso 0 dist 6.72502 8.60554 6.99746 14.6259 11.2485 8.4051 14.012 11.5841 6.72323 12.176 numMergedOcc 0
15 mol 24 unq 5 iso 0 dist 6.72502 8.60554 6.99746 10.0952 10.7114 7.29868 14.012 11.5841 6.72323 6.66749 numMergedOcc 0
16 mol 24 unq 6 iso 0 dist 4.93188 6.73939 10.0715 11.4989 13.0257 9.41441 6.56748 11.4664 5.95834 12.2662 numMergedOcc 0
17 mol 24 unq 7 iso 0 dist 4.93188 6.73939 10.0715 11.4989 13.0257 9.41441 4.50066 8.78859 4.2121 8.67951 numMergedOcc 0
18 mol 24 unq 8 iso 0 dist 4.93188 6.73939 10.0715 11.4989 13.0257 9.41441 11.9112 14.7684 8.00171 4.32034 numMergedOcc 0
19 mol 24 unq 9 iso 0 dist 4.93188 6.73939 10.0715 11.4989 13.0257 9.41441 5.11617 4.90592 6.72323 8.52463 numMergedOcc 0
20 mol 25 unq 0 iso 0 dist 6.90155 6.16347 11.0508 10.9391 17.3821 7.45383 6.08585 12.7162 6.25843 5.77929 numMergedOcc 0
21 mol 25 unq 1 iso 0 dist 6.6492 7.45383 11.7817 10.9391 16.357 6.16347 5.77929 11.4352 6.25843 6.08585 numMergedOcc 0
22 mol 26 unq 0 iso 0 dist 8.6385 7.36856 5.30297 7.96502 10.4035 6.46104 5.81765 10.9962 6.93197 7.23703 numMergedOcc 0
23 mol 65 unq 0 iso 0 dist 9.14931 6.72639 9.35965 5.48814 13.4288 6.76508 5.51708 11.606 5.94206 6.47381 numMergedOcc 0
24 mol 65 unq 1 iso 0 dist 8.37515 6.76508 7.18126 5.48814 12.0267 6.72639 6.47381 11.2032 5.94206 5.51708 numMergedOcc 0
25 mol 98 unq 0 iso 0 dist 5.88354 5.59328 8.53212 10.6225 14.2622 5.78706 4.67519 6.62972 7.14031 11.3905 numMergedOcc 0
26 mol 98 unq 1 iso 0 dist 5.88354 5.59328 8.53212 11.4338 13.6237 7.23884 4.67519 6.62972 7.14031 14.2646 numMergedOcc 0
27 mol 98 unq 2 iso 0 dist 5.88354 5.59328 8.53212 7.72877 5.74854 7.5242 4.67519 6.62972 7.14031 10.4027 numMergedOcc 0
28 mol 98 unq 3 iso 0 dist 5.74854 7.5242 8.53212 12.7411 14.2622 5.78706 10.4027 6.62972 7.14031 11.3905 numMergedOcc 0
29 mol 98 unq 4 iso 0 dist 5.74854 7.5242 8.53212 9.30161 13.6237 7.23884 10.4027 6.62972 7.14031 14.2646 numMergedOcc 0
30 mol 98 unq 5 iso 0 dist 5.74854 7.5242 8.53212 7.72877 5.88354 5.59328 10.4027 6.62972 7.14031 4.67519 numMergedOcc 0
31 mol 133 unq 0 iso 0 dist 6.76699 6.16242 9.34112 7.81217 11.1595 5.87634 12.131 13.4305 8.95662 14.8102 numMergedOcc 0
32 mol 134 unq 0 iso 0 dist 5.53031 7.80532 8.98004 5.79898 10.0513 5.83771 5.71679 10.0154 6.40575 4.60632 numMergedOcc 0
33 mol 141 unq 0 iso 0 dist 7.86572 9.97343 5.38571 11.4307 10.271 9.70413 9.74444 12.165 9.10042 10.3716 numMergedOcc 0
34 mol 141 unq 1 iso 0 dist 7.86572 9.97343 5.38571 11.4307 10.271 9.70413 6.91919 10.7655 9.75059 7.87881 numMergedOcc 0
35 mol 141 unq 2 iso 0 dist 7.86572 9.97343 5.38571 11.4307 10.271 9.70413 10.1432 4.46777 6.83404 7.27731 numMergedOcc 0
36 mol 171 unq 0 iso 0 dist 7.71426 5.93786 6.29877 4.91149 11.3367 6.64834 5.48551 10.352 7.22518 6.45673 numMergedOcc 0
37 mol 171 unq 1 iso 0 dist 7.71426 5.93786 6.29877 4.91149 11.3367 6.64834 7.9651 11.4752 5.25109 4.78075 numMergedOcc 0
38 mol 171 unq 2 iso 0 dist 7.71426 5.93786 6.29877 7.31409 5.10618 8.24693 5.48551 10.352 7.22518 8.05069 numMergedOcc 0
39 mol 171 unq 3 iso 0 dist 7.71426 5.93786 6.29877 7.31409 5.10618 8.24693 7.9651 11.4752 5.25109 12.6853 numMergedOcc 0
40 mol 171 unq 4 iso 0 dist 7.71426 5.93786 6.29877 8.07119 11.661 7.36698 5.48551 10.352 7.22518 11.2785 numMergedOcc 0
41 mol 171 unq 5 iso 0 dist 7.71426 5.93786 6.29877 8.07119 11.661 7.36698 7.9651 11.4752 5.25109 5.90026 numMergedOcc 0
42 mol 171 unq 6 iso 0 dist 7.71426 8.1344 5.90358 7.31409 5.10618 6.71356 5.48551 10.352 7.58499 8.05069 numMergedOcc 0
43 mol 171 unq 7 iso 0 dist 7.71426 8.1344 5.90358 7.31409 5.10618 6.71356 7.9651 11.4752 8.21618 12.6853 numMergedOcc 0
44 mol 171 unq 8 iso 0 dist 5.10618 8.24693 6.29877 11.6409 11.3367 6.64834 8.05069 10.352 7.22518 6.45673 numMergedOcc 0
45 mol 171 unq 9 iso 0 dist 5.10618 8.24693 6.29877 11.6409 11.3367 6.64834 12.6853 11.4752 5.25109 4.78075 numMergedOcc 0
46 mol 171 unq 10 iso 0 dist 5.10618 8.24693 6.29877 7.31409 7.71426 5.93786 8.05069 10.352 7.22518 5.48551 numMergedOcc 0
47 mol 171 unq 11 iso 0 dist 5.10618 8.24693 6.29877 7.31409 7.71426 5.93786 12.6853 11.4752 5.25109 7.9651 numMergedOcc 0
48 mol 171 unq 12 iso 0 dist 5.10618 8.24693 6.29877 14.1033 11.661 7.36698 8.05069 10.352 7.22518 11.2785 numMergedOcc 0
49 mol 171 unq 13 iso 0 dist 5.10618 8.24693 6.29877 14.1033 11.661 7.36698 12.6853 11.4752 5.25109 5.90026 numMergedOcc 0
50 mol 171 unq 14 iso 0 dist 5.10618 6.71356 5.90358 7.31409 7.71426 8.1344 8.05069 10.352 7.58499 5.48551 numMergedOcc 0
51 mol 171 unq 15 iso 0 dist 5.10618 6.71356 5.90358 7.31409 7.71426 8.1344 12.6853 11.4752 8.21618 7.9651 numMergedOcc 0
52 mol 235 unq 0 iso 0 dist 6.39158 6.36341 7.85398 8.31875 11.0084 6.21292 5.5163 11.4177 6.94789 7.77516 numMergedOcc 0
53 mol 235 unq 1 iso 0 dist 6.39158 6.36341 7.85398 10.5547 11.2916 9.21736 5.5163 11.4177 6.94789 11.7254 numMergedOcc 0
