0 mol 0 unq 0 iso 0 dist 8.99617 8.86609 11.2254 11.2001 9.19007 12.4853 14.0721 9.64573 18.2113 7.65806 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 5.78238 9.03541 7.56164 9.59761 6.60423 12.3058 10.6042 6.00575 13.0134 6.86014 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 5.78238 9.03541 7.56164 9.59761 6.60423 12.3058 9.90845 5.97304 4.79736 8.86116 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.33162 9.04174 4.69849 9.97169 8.44903 6.66407 12.2944 5.48048 5.07458 5.73819 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 9.41473 9.23033 4.55347 6.6796 9.93832 6.6263 13.3486 9.06158 5.41726 8.80331 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 9.41473 9.23033 4.55347 10.2523 8.60739 6.75943 12.49 5.64171 4.96926 5.73819 numMergedOcc 0
6 mol 43 unq 3 iso 0 dist 9.41473 9.23033 4.55347 10.2523 8.60739 6.75943 13.3486 9.06158 5.41726 6.20293 numMergedOcc 0
7 mol 43 unq 4 iso 0 dist 9.41473 9.23033 4.55347 10.2523 8.60739 6.75943 17.9394 11.3891 10.0383 8.93915 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 6.59232 5.79157 5.56296 6.71593 8.85586 10.2939 14.6361 14.8866 15.9527 8.70481 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 6.59232 7.91605 5.50891 6.71593 8.85586 5.5087 14.6361 14.8866 11.2069 8.70481 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 6.59232 6.43707 4.75954 6.71593 8.85586 6.08682 14.6361 14.8866 10.6713 8.70481 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 8.98581 6.45477 3.75378 4.98373 7.63338 7.36975 9.73212 12.8872 13.1926 5.99315 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 5.32236 8.87876 5.65909 5.96451 8.0154 10.8463 9.00898 4.24624 5.57734 9.29945 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.51006 9.82338 8.58039 10.568 7.20574 6.61112 16.7935 8.90184 11.0961 7.54065 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 9.51006 9.82338 8.58039 11.1286 6.85302 11.456 16.7935 8.90184 11.0961 8.87694 numMergedOcc 0
15 mol 186 unq 2 iso 0 dist 9.51006 9.82338 8.58039 11.1286 6.85302 11.456 13.2605 4.37002 12.4091 9.09754 numMergedOcc 0
16 mol 186 unq 3 iso 0 dist 9.51006 7.99933 9.96652 10.568 7.20574 11.4283 16.7935 8.90184 15.843 7.54065 numMergedOcc 0
17 mol 186 unq 4 iso 0 dist 9.51006 7.99933 9.96652 11.1286 6.85302 14.6051 16.7935 8.90184 15.843 8.87694 numMergedOcc 0
18 mol 186 unq 5 iso 0 dist 9.51006 7.99933 9.96652 11.1286 6.85302 14.6051 13.2605 4.37002 13.3926 9.09754 numMergedOcc 0
19 mol 186 unq 6 iso 0 dist 9.05979 7.7734 11.1813 8.86145 8.64409 15.4849 12.6312 9.97575 15.6573 9.09754 numMergedOcc 0
20 mol 223 unq 0 iso 0 dist 6.82737 8.85178 4.40141 4.67731 6.13306 6.42257 12.0111 6.52273 4.04036 8.77153 numMergedOcc 0
21 mol 223 unq 1 iso 0 dist 6.82737 8.85178 4.40141 4.67731 6.13306 6.42257 10.6785 7.12885 9.47076 8.6166 numMergedOcc 0
22 mol 223 unq 2 iso 0 dist 6.82737 9.73123 9.63911 4.67731 6.13306 9.33543 12.0111 6.52273 13.1538 8.77153 numMergedOcc 0
23 mol 223 unq 3 iso 0 dist 6.82737 9.73123 9.63911 4.67731 6.13306 9.33543 10.6785 7.12885 5.39728 8.6166 numMergedOcc 0
24 mol 223 unq 4 iso 0 dist 6.80967 5.50267 4.40141 7.19485 6.13306 6.42257 9.5211 6.52273 4.04036 8.77153 numMergedOcc 0
25 mol 223 unq 5 iso 0 dist 6.80967 5.50267 4.40141 7.19485 6.13306 6.42257 13.3416 7.12885 9.47076 8.6166 numMergedOcc 0
26 mol 232 unq 0 iso 0 dist 6.29118 9.11418 8.03712 4.90814 7.83711 6.71524 11.2186 8.25884 5.10213 8.27212 numMergedOcc 0
27 mol 248 unq 0 iso 0 dist 8.46518 7.90773 7.14182 4.53213 6.17052 9.05018 8.71859 5.99459 4.58289 7.69895 numMergedOcc 0
28 mol 248 unq 1 iso 0 dist 8.46518 7.90773 7.14182 6.33032 9.77666 9.33962 8.71859 5.99459 4.58289 7.21521 numMergedOcc 0
29 mol 252 unq 0 iso 0 dist 6.88874 4.54745 4.34126 5.26867 6.86945 7.15764 9.73021 5.25252 7.40852 7.19638 numMergedOcc 0
