0 mol 7 unq 0 iso 0 dist 9.20552 15.1647 8.41585 14.4965 12.8323 9.87885 10.1377 12.2333 13.2247 6.1206 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 6.68517 5.65481 4.7319 10.0048 6.86055 7.65889 10.0664 11.0958 10.2656 6.42835 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 6.84521 5.84171 5.73819 10.8355 4.96926 6.75943 13.9129 10.5523 8.13395 6.6263 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.06275 5.5249 8.80331 8.74209 5.41726 6.6263 10.4413 6.20293 8.13395 6.75943 numMergedOcc 0
4 mol 43 unq 2 iso 0 dist 8.06275 10.4413 6.20293 8.74209 5.41726 6.75943 5.5249 8.80331 8.13395 6.6263 numMergedOcc 0
5 mol 43 unq 3 iso 0 dist 8.90024 13.9129 8.80331 10.8355 5.41726 6.6263 5.84171 6.20293 8.13395 6.75943 numMergedOcc 0
6 mol 43 unq 4 iso 0 dist 8.90024 5.84171 6.20293 10.8355 5.41726 6.75943 13.9129 8.80331 8.13395 6.6263 numMergedOcc 0
7 mol 43 unq 5 iso 0 dist 6.78532 5.84171 8.93915 10.8355 10.0383 6.75943 13.9129 14.7803 8.13395 6.6263 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 5.48831 13.0773 9.96708 11.3204 7.47371 7.12321 11.4864 10.8086 5.36766 9.74228 numMergedOcc 0
9 mol 72 unq 1 iso 0 dist 5.48831 13.0773 9.96708 11.3204 7.47371 7.12321 10.5933 9.78528 8.24309 6.21799 numMergedOcc 0
10 mol 72 unq 2 iso 0 dist 5.48831 10.5933 9.78528 11.3204 7.47371 6.21799 11.4864 10.8086 7.04035 9.74228 numMergedOcc 0
11 mol 72 unq 3 iso 0 dist 5.48831 10.5933 9.78528 11.3204 7.47371 6.21799 13.0773 9.96708 8.24309 7.12321 numMergedOcc 0
12 mol 72 unq 4 iso 0 dist 5.48831 10.5933 9.78528 12.3271 9.67587 5.03251 15.4881 15.1902 5.8486 9.56773 numMergedOcc 0
13 mol 95 unq 0 iso 0 dist 7.90775 4.16047 9.03572 8.57607 4.99174 8.27883 8.68514 11.5113 6.59884 7.7152 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 9.83528 12.3158 5.08437 11.8912 3.9764 5.10496 15.1765 6.48948 9.51923 5.92242 numMergedOcc 0
15 mol 98 unq 1 iso 0 dist 9.83528 12.3158 5.08437 11.8912 3.9764 5.10496 8.06684 6.10456 8.40073 5.2571 numMergedOcc 0
16 mol 98 unq 2 iso 0 dist 9.83528 12.3158 5.08437 11.8912 3.9764 5.10496 9.05486 10.1136 10.2427 8.7497 numMergedOcc 0
17 mol 98 unq 3 iso 0 dist 9.83528 15.1765 6.48948 11.8912 3.9764 5.92242 12.3158 5.08437 9.51923 5.10496 numMergedOcc 0
18 mol 98 unq 4 iso 0 dist 9.83528 15.1765 6.48948 11.8912 3.9764 5.92242 8.06684 6.10456 9.42358 5.2571 numMergedOcc 0
19 mol 98 unq 5 iso 0 dist 9.83528 15.1765 6.48948 11.8912 3.9764 5.92242 9.05486 10.1136 13.9786 8.7497 numMergedOcc 0
20 mol 98 unq 6 iso 0 dist 9.83528 8.06684 6.10456 15.2524 10.4782 7.54889 21.0334 17.4071 13.659 9.64383 numMergedOcc 0
21 mol 98 unq 7 iso 0 dist 9.83528 8.06684 6.10456 15.2524 10.4782 7.54889 9.05486 10.1136 5.02887 7.78931 numMergedOcc 0
22 mol 98 unq 8 iso 0 dist 9.83528 8.06684 6.10456 11.8912 3.9764 5.2571 12.3158 5.08437 8.40073 5.10496 numMergedOcc 0
23 mol 98 unq 9 iso 0 dist 9.83528 8.06684 6.10456 11.8912 3.9764 5.2571 15.1765 6.48948 9.42358 5.92242 numMergedOcc 0
24 mol 98 unq 10 iso 0 dist 9.83528 8.06684 6.10456 11.8912 3.9764 5.2571 9.05486 10.1136 5.02887 8.7497 numMergedOcc 0
25 mol 98 unq 11 iso 0 dist 7.54969 11.7493 5.08437 8.79016 3.9764 5.10496 10.3366 6.48948 9.51923 5.92242 numMergedOcc 0
26 mol 98 unq 12 iso 0 dist 7.54969 11.7493 5.08437 8.79016 3.9764 5.10496 5.15322 6.10456 8.40073 5.2571 numMergedOcc 0
27 mol 98 unq 13 iso 0 dist 7.54969 11.7493 5.08437 8.79016 3.9764 5.10496 9.07049 10.1136 10.2427 8.7497 numMergedOcc 0
28 mol 98 unq 14 iso 0 dist 7.54969 10.3366 6.48948 8.79016 3.9764 5.92242 11.7493 5.08437 9.51923 5.10496 numMergedOcc 0
29 mol 98 unq 15 iso 0 dist 7.54969 10.3366 6.48948 8.79016 3.9764 5.92242 5.15322 6.10456 9.42358 5.2571 numMergedOcc 0
30 mol 98 unq 16 iso 0 dist 7.54969 10.3366 6.48948 8.79016 3.9764 5.92242 9.07049 10.1136 13.9786 8.7497 numMergedOcc 0
31 mol 98 unq 17 iso 0 dist 7.54969 5.15322 6.10456 12.301 10.4782 7.54889 16.1406 17.4071 13.659 9.64383 numMergedOcc 0
32 mol 98 unq 18 iso 0 dist 7.54969 5.15322 6.10456 12.301 10.4782 7.54889 9.07049 10.1136 5.02887 7.78931 numMergedOcc 0
33 mol 98 unq 19 iso 0 dist 7.54969 5.15322 6.10456 8.79016 3.9764 5.2571 11.7493 5.08437 8.40073 5.10496 numMergedOcc 0
34 mol 98 unq 20 iso 0 dist 7.54969 5.15322 6.10456 8.79016 3.9764 5.2571 10.3366 6.48948 9.42358 5.92242 numMergedOcc 0
35 mol 98 unq 21 iso 0 dist 7.54969 5.15322 6.10456 8.79016 3.9764 5.2571 9.07049 10.1136 5.02887 8.7497 numMergedOcc 0
36 mol 109 unq 0 iso 0 dist 9.26438 5.68669 8.69985 6.62354 5.00433 8.52024 4.91393 13.1098 7.15843 9.89083 numMergedOcc 0
37 mol 109 unq 1 iso 0 dist 6.43255 6.80429 8.69985 8.00085 5.00433 8.52024 12.0697 13.1098 7.15843 9.89083 numMergedOcc 0
38 mol 109 unq 2 iso 0 dist 7.4389 12.3794 8.69985 11.8878 5.00433 8.52024 18.5281 13.1098 7.15843 9.89083 numMergedOcc 0
39 mol 133 unq 0 iso 0 dist 7.5055 10.9541 8.22656 10.7738 4.88025 8.26547 5.61003 6.82262 5.61668 9.05342 numMergedOcc 0
40 mol 133 unq 1 iso 0 dist 7.5055 5.61003 6.82262 10.7738 4.88025 9.05342 10.9541 8.22656 5.61668 8.26547 numMergedOcc 0
41 mol 134 unq 0 iso 0 dist 8.84656 10.879 6.37586 14.395 10.8635 9.33094 16.7911 9.71307 6.81259 8.69531 numMergedOcc 0
42 mol 134 unq 1 iso 0 dist 8.84656 16.7911 9.71307 18.4308 15.0225 9.1998 16.8459 15.6507 11.6064 6.42772 numMergedOcc 0
43 mol 134 unq 2 iso 0 dist 8.84656 16.7911 9.71307 18.4308 15.0225 9.1998 22.6898 15.9508 7.09823 8.70621 numMergedOcc 0
44 mol 134 unq 3 iso 0 dist 8.84656 16.7911 9.71307 14.395 10.8635 8.69531 10.879 6.37586 6.81259 9.33094 numMergedOcc 0
45 mol 134 unq 4 iso 0 dist 4.9155 10.879 6.49416 14.395 12.3479 9.33094 16.7911 12.5075 6.81259 8.69531 numMergedOcc 0
46 mol 134 unq 5 iso 0 dist 8.49987 10.9399 6.49416 14.5869 12.3479 9.33094 17.2658 12.5075 6.81259 8.69531 numMergedOcc 0
47 mol 134 unq 6 iso 0 dist 9.42271 7.07625 6.49416 6.14652 12.3479 9.33094 10.4858 12.5075 6.81259 8.69531 numMergedOcc 0
48 mol 134 unq 7 iso 0 dist 5.79157 13.0109 9.86662 8.8437 4.00092 7.21868 11.9678 11.3835 5.62899 9.66543 numMergedOcc 0
49 mol 134 unq 8 iso 0 dist 5.79157 13.0109 9.86662 8.8437 4.00092 7.21868 14.1608 9.71307 5.49782 7.93372 numMergedOcc 0
50 mol 134 unq 9 iso 0 dist 5.79157 14.1608 9.71307 8.8437 4.00092 7.93372 11.9678 11.3835 10.7144 9.66543 numMergedOcc 0
51 mol 134 unq 10 iso 0 dist 5.79157 14.1608 9.71307 8.8437 4.00092 7.93372 13.0109 9.86662 5.49782 7.21868 numMergedOcc 0
52 mol 152 unq 0 iso 0 dist 8.34839 5.65129 8.56324 9.4275 5.39112 6.59889 10.5295 6.70283 7.65448 6.70693 numMergedOcc 0
53 mol 152 unq 1 iso 0 dist 8.34839 10.5295 6.70283 9.4275 5.39112 6.70693 5.65129 8.56324 7.65448 6.59889 numMergedOcc 0
54 mol 167 unq 0 iso 0 dist 6.53913 12.4033 9.87651 11.4273 12.0033 9.2289 12.6052 12.4733 4.70068 7.68266 numMergedOcc 0
55 mol 167 unq 1 iso 0 dist 6.53913 12.4033 9.87651 11.4273 12.0033 9.2289 16.708 17.5366 10.3445 7.6616 numMergedOcc 0
56 mol 167 unq 2 iso 0 dist 6.53913 12.4033 9.87651 12.8389 11.6011 7.02548 12.6052 12.4733 4.70068 6.84752 numMergedOcc 0
57 mol 167 unq 3 iso 0 dist 6.53913 12.4033 9.87651 12.8389 11.6011 7.02548 16.708 17.5366 10.3445 7.86563 numMergedOcc 0
58 mol 181 unq 0 iso 0 dist 9.74465 8.42326 8.03334 11.0622 6.50233 9.76212 9.65078 10.9639 6.01247 8.59874 numMergedOcc 0
59 mol 224 unq 0 iso 0 dist 8.14754 7.43271 5.81334 11.7375 4.54188 6.8692 17.9507 10.9745 11.328 6.99769 numMergedOcc 0
60 mol 224 unq 1 iso 0 dist 8.14754 7.43271 5.81334 11.7375 4.54188 6.8692 15.5444 10.5128 8.49799 8.79428 numMergedOcc 0
61 mol 229 unq 0 iso 0 dist 6.32302 6.52416 8.22528 9.90415 5.70473 7.27993 9.71486 11.3979 5.1556 9.51168 numMergedOcc 0
62 mol 229 unq 1 iso 0 dist 6.32302 6.52416 8.22528 9.90415 5.70473 7.27993 12.9522 11.7165 7.0298 6.95201 numMergedOcc 0
63 mol 229 unq 2 iso 0 dist 6.88694 6.52416 7.03423 9.90415 7.22525 7.27993 9.71486 11.9282 5.1556 9.51168 numMergedOcc 0
64 mol 229 unq 3 iso 0 dist 6.88694 6.52416 7.03423 9.90415 7.22525 7.27993 12.9522 11.4362 7.0298 6.95201 numMergedOcc 0
65 mol 229 unq 4 iso 0 dist 8.53615 6.81165 8.22528 5.96615 5.70473 7.27993 5.33253 11.3979 5.1556 9.51168 numMergedOcc 0
66 mol 229 unq 5 iso 0 dist 8.53615 6.81165 8.22528 5.96615 5.70473 7.27993 6.21905 11.7165 7.0298 6.95201 numMergedOcc 0
67 mol 238 unq 0 iso 0 dist 8.97461 11.6506 7.31233 18.2277 10.3162 9.12776 26.829 19.5656 15.7907 9.72188 numMergedOcc 0
68 mol 239 unq 0 iso 0 dist 8.82778 11.4665 6.16342 11.7834 10.6736 6.73665 20.7084 16.5158 11.347 9.34438 numMergedOcc 0
69 mol 239 unq 1 iso 0 dist 8.82778 11.4665 6.16342 11.7834 10.6736 6.73665 16.2897 13.7154 7.97994 9.35949 numMergedOcc 0
