0 mol 9 unq 0 iso 0 dist 8.04924 6.81435 5.55437 3.91075 7.05919 8.17486 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 8.98797 5.73443 6.91393 6.43007 5.07125 8.12964 numMergedOcc 0
2 mol 56 unq 1 iso 0 dist 8.98797 11.075 8.40038 6.43007 5.07125 11.6453 numMergedOcc 0
3 mol 93 unq 0 iso 0 dist 7.85041 9.97157 5.51624 12.1673 7.8435 4.97727 numMergedOcc 0
4 mol 93 unq 1 iso 0 dist 7.85041 9.97157 5.51624 7.30779 5.99269 5.77343 numMergedOcc 0
5 mol 93 unq 2 iso 0 dist 7.85041 9.97157 5.51624 9.18194 5.71763 11.0802 numMergedOcc 0
6 mol 93 unq 3 iso 0 dist 7.85041 8.01991 7.8674 12.1673 7.8435 13.8087 numMergedOcc 0
7 mol 93 unq 4 iso 0 dist 7.85041 8.01991 7.8674 7.30779 5.99269 9.96831 numMergedOcc 0
8 mol 93 unq 5 iso 0 dist 7.85041 8.01991 7.8674 9.18194 5.71763 5.33894 numMergedOcc 0
9 mol 105 unq 0 iso 0 dist 7.20953 6.14305 8.44437 4.67929 7.44838 9.02856 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 9.9928 6.03931 8.71286 13.2709 8.4965 8.80697 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 9.39683 12.4067 7.76594 8.34485 6.78801 4.24991 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 5.1101 6.29593 9.23528 11.4653 9.43989 17.3765 numMergedOcc 0
13 mol 147 unq 1 iso 0 dist 7.01133 11.2831 9.23528 7.68412 9.43989 17.3765 numMergedOcc 0
14 mol 154 unq 0 iso 0 dist 7.53158 6.2969 9.14458 12.9875 9.82982 17.2648 numMergedOcc 0
15 mol 154 unq 1 iso 0 dist 7.43407 6.70864 9.14458 11.8727 9.82982 17.2648 numMergedOcc 0
16 mol 171 unq 0 iso 0 dist 5.73148 7.48646 7.82546 11.9654 9.13027 8.8243 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 7.94153 7.0016 8.12349 5.93479 7.04815 9.57029 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 7.94153 7.0016 8.12349 5.86306 6.07389 10.8203 numMergedOcc 0
19 mol 193 unq 0 iso 0 dist 8.76185 11.5632 5.44396 14.0247 7.39445 3.9625 numMergedOcc 0
20 mol 193 unq 1 iso 0 dist 8.76185 5.08201 6.22972 14.0247 7.39445 9.42379 numMergedOcc 0
21 mol 194 unq 0 iso 0 dist 9.77862 12.0339 5.52678 8.31541 5.53324 5.28603 numMergedOcc 0
22 mol 194 unq 1 iso 0 dist 9.77862 12.0339 5.52678 6.72001 6.72182 9.8803 numMergedOcc 0
23 mol 194 unq 2 iso 0 dist 9.77862 18.7006 9.81666 8.31541 5.53324 11.0713 numMergedOcc 0
24 mol 194 unq 3 iso 0 dist 9.77862 18.7006 9.81666 6.72001 6.72182 15.9964 numMergedOcc 0
25 mol 225 unq 0 iso 0 dist 7.29542 7.13893 6.53728 13.317 9.87668 6.35462 numMergedOcc 0
26 mol 225 unq 1 iso 0 dist 7.29542 7.13893 6.53728 10.43 8.42121 5.94765 numMergedOcc 0
27 mol 225 unq 2 iso 0 dist 7.29542 7.13893 6.53728 6.24324 7.8744 11.6976 numMergedOcc 0
28 mol 225 unq 3 iso 0 dist 7.29542 7.13893 6.53728 10.7885 4.98402 11.2847 numMergedOcc 0
29 mol 227 unq 0 iso 0 dist 9.20589 8.84427 9.56257 9.08701 5.28771 11.2819 numMergedOcc 0
30 mol 227 unq 1 iso 0 dist 7.89801 5.95112 9.56257 12.0749 5.28771 11.2819 numMergedOcc 0
31 mol 227 unq 2 iso 0 dist 7.1372 5.92529 9.56257 4.09934 9.43618 7.3164 numMergedOcc 0
32 mol 237 unq 0 iso 0 dist 7.35569 16.0031 9.84466 9.99177 8.7414 9.39277 numMergedOcc 0
33 mol 237 unq 1 iso 0 dist 7.35569 10.1969 6.16557 9.99177 8.7414 5.1975 numMergedOcc 0
34 mol 237 unq 2 iso 0 dist 7.35569 7.50329 5.4813 9.99177 8.7414 5.69816 numMergedOcc 0
35 mol 238 unq 0 iso 0 dist 7.61203 10.6355 9.89583 9.75095 6.53286 13.0611 numMergedOcc 0
36 mol 238 unq 1 iso 0 dist 9.47845 6.48619 9.89583 11.7938 6.53286 13.0611 numMergedOcc 0
37 mol 238 unq 2 iso 0 dist 6.92409 5.8333 9.89583 11.7709 6.53286 13.0611 numMergedOcc 0
38 mol 238 unq 3 iso 0 dist 6.89694 16.1577 9.89583 6.12722 6.53286 13.0611 numMergedOcc 0
39 mol 250 unq 0 iso 0 dist 8.70484 6.11942 9.60364 9.91231 7.22664 8.9822 numMergedOcc 0
40 mol 250 unq 1 iso 0 dist 8.70484 6.11942 9.60364 8.25599 7.15762 11.5018 numMergedOcc 0
41 mol 264 unq 0 iso 0 dist 9.42738 8.79843 5.74568 9.04569 7.14086 7.36132 numMergedOcc 0
42 mol 284 unq 0 iso 0 dist 8.27054 12.9607 7.97588 9.97692 9.07503 5.54893 numMergedOcc 0
43 mol 284 unq 1 iso 0 dist 8.27054 12.9607 7.97588 10.6148 7.63256 3.89435 numMergedOcc 0
