0 mol 9 unq 0 iso 0 dist 9.93613 9.03359 8.04924 6.49896 5.55437 6.81435 12.0088 7.05919 3.91075 8.17486 numMergedOcc 0
1 mol 93 unq 0 iso 0 dist 8.42713 12.5605 7.85041 8.02579 5.51624 9.97157 3.91263 7.8435 12.1673 4.97727 numMergedOcc 0
2 mol 93 unq 1 iso 0 dist 8.42713 12.5605 7.85041 8.02579 5.51624 9.97157 5.59024 5.99269 7.30779 5.77343 numMergedOcc 0
3 mol 93 unq 2 iso 0 dist 8.42713 12.5605 7.85041 8.02579 5.51624 9.97157 12.9872 5.71763 9.18194 11.0802 numMergedOcc 0
4 mol 93 unq 3 iso 0 dist 8.42713 12.5605 7.85041 12.3147 7.8674 8.01991 3.91263 7.8435 12.1673 13.8087 numMergedOcc 0
5 mol 93 unq 4 iso 0 dist 8.42713 12.5605 7.85041 12.3147 7.8674 8.01991 5.59024 5.99269 7.30779 9.96831 numMergedOcc 0
6 mol 93 unq 5 iso 0 dist 8.42713 12.5605 7.85041 12.3147 7.8674 8.01991 12.9872 5.71763 9.18194 5.33894 numMergedOcc 0
7 mol 93 unq 6 iso 0 dist 8.21032 10.878 7.85041 12.1011 5.51624 9.97157 15.8131 7.8435 12.1673 4.97727 numMergedOcc 0
8 mol 93 unq 7 iso 0 dist 8.21032 10.878 7.85041 12.1011 5.51624 9.97157 13.6266 5.99269 7.30779 5.77343 numMergedOcc 0
9 mol 93 unq 8 iso 0 dist 8.21032 10.878 7.85041 12.1011 5.51624 9.97157 5.17052 5.71763 9.18194 11.0802 numMergedOcc 0
10 mol 93 unq 9 iso 0 dist 8.21032 10.878 7.85041 9.97789 7.8674 8.01991 15.8131 7.8435 12.1673 13.8087 numMergedOcc 0
11 mol 93 unq 10 iso 0 dist 8.21032 10.878 7.85041 9.97789 7.8674 8.01991 13.6266 5.99269 7.30779 9.96831 numMergedOcc 0
12 mol 93 unq 11 iso 0 dist 8.21032 10.878 7.85041 9.97789 7.8674 8.01991 5.17052 5.71763 9.18194 5.33894 numMergedOcc 0
13 mol 147 unq 0 iso 0 dist 6.4752 4.10092 5.1101 6.96543 9.23528 6.29593 11.5768 9.43989 11.4653 17.3765 numMergedOcc 0
14 mol 147 unq 1 iso 0 dist 6.4752 4.47436 7.01133 6.96543 9.23528 11.2831 11.5768 9.43989 7.68412 17.3765 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 9.2042 12.9483 7.53158 15.6002 9.14458 6.2969 5.18463 9.82982 12.9875 17.2648 numMergedOcc 0
16 mol 154 unq 1 iso 0 dist 9.2042 9.90775 7.43407 15.6002 9.14458 6.70864 5.18463 9.82982 11.8727 17.2648 numMergedOcc 0
17 mol 194 unq 0 iso 0 dist 7.47107 11.5684 9.77862 11.4288 5.52678 12.0339 12.1522 5.53324 8.31541 5.28603 numMergedOcc 0
18 mol 194 unq 1 iso 0 dist 7.47107 11.5684 9.77862 11.4288 5.52678 12.0339 5.18485 6.72182 6.72001 9.8803 numMergedOcc 0
19 mol 194 unq 2 iso 0 dist 7.47107 11.5684 9.77862 15.4624 9.81666 18.7006 12.1522 5.53324 8.31541 11.0713 numMergedOcc 0
20 mol 194 unq 3 iso 0 dist 7.47107 11.5684 9.77862 15.4624 9.81666 18.7006 5.18485 6.72182 6.72001 15.9964 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 8.28454 8.59036 7.29542 7.01029 6.53728 7.13893 11.1052 9.87668 13.317 6.35462 numMergedOcc 0
22 mol 225 unq 1 iso 0 dist 8.28454 8.59036 7.29542 7.01029 6.53728 7.13893 3.60045 8.42121 10.43 5.94765 numMergedOcc 0
23 mol 225 unq 2 iso 0 dist 8.28454 8.59036 7.29542 7.01029 6.53728 7.13893 12.7272 7.8744 6.24324 11.6976 numMergedOcc 0
24 mol 225 unq 3 iso 0 dist 8.28454 8.59036 7.29542 7.01029 6.53728 7.13893 10.6169 4.98402 10.7885 11.2847 numMergedOcc 0
25 mol 227 unq 0 iso 0 dist 8.12518 4.71182 9.20589 9.41039 9.56257 8.84427 10.4658 5.28771 9.08701 11.2819 numMergedOcc 0
26 mol 227 unq 1 iso 0 dist 8.12518 7.51342 7.89801 9.41039 9.56257 5.95112 10.4658 5.28771 12.0749 11.2819 numMergedOcc 0
27 mol 237 unq 0 iso 0 dist 9.74081 9.68452 7.35569 12.7987 9.84466 16.0031 6.94282 8.7414 9.99177 9.39277 numMergedOcc 0
28 mol 237 unq 1 iso 0 dist 9.74081 9.68452 7.35569 5.78318 6.16557 10.1969 6.94282 8.7414 9.99177 5.1975 numMergedOcc 0
29 mol 237 unq 2 iso 0 dist 9.74081 9.68452 7.35569 10.217 5.4813 7.50329 6.94282 8.7414 9.99177 5.69816 numMergedOcc 0
30 mol 250 unq 0 iso 0 dist 9.43554 14.0983 8.70484 15.3306 9.60364 6.11942 6.9412 7.22664 9.91231 8.9822 numMergedOcc 0
31 mol 250 unq 1 iso 0 dist 9.43554 14.0983 8.70484 15.3306 9.60364 6.11942 6.56481 7.15762 8.25599 11.5018 numMergedOcc 0
32 mol 250 unq 2 iso 0 dist 9.21681 10.9117 8.70484 14.1113 9.60364 6.11942 15.9167 7.22664 9.91231 8.9822 numMergedOcc 0
33 mol 250 unq 3 iso 0 dist 9.21681 10.9117 8.70484 14.1113 9.60364 6.11942 12.9916 7.15762 8.25599 11.5018 numMergedOcc 0
34 mol 264 unq 0 iso 0 dist 8.28871 9.63193 9.42738 5.7394 5.74568 8.79843 3.63202 7.14086 9.04569 7.36132 numMergedOcc 0
35 mol 264 unq 1 iso 0 dist 7.94668 12.2052 9.42738 6.63115 5.74568 8.79843 13.3131 7.14086 9.04569 7.36132 numMergedOcc 0
