0 mol 7 unq 0 iso 0 dist 9.20552 15.1647 8.41585 16.2149 14.7759 9.68596 14.6861 10.3148 5.03847 6.14469 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.40392 8.23069 5.54419 13.3777 12.176 6.73939 14.1209 16.8439 11.9112 8.00171 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 7.40392 8.23069 5.54419 13.3777 12.176 6.73939 12.5021 11.3566 6.56748 5.95834 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 7.40392 8.23069 5.54419 13.3777 12.176 6.73939 9.82763 9.83002 4.50066 4.2121 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 7.40392 8.23069 5.54419 13.3777 12.176 6.73939 8.92687 8.4051 5.11617 6.72323 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 8.94828 14.2406 7.57578 12.0615 6.08585 8.50222 6.84017 6.16347 9.34396 6.25843 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 8.94828 14.2406 7.57578 12.0615 6.08585 8.50222 19.4958 13.8469 10.5328 8.88938 numMergedOcc 0
7 mol 25 unq 2 iso 0 dist 8.94828 15.6642 7.17969 12.0615 6.08585 7.55264 6.84017 6.16347 10.8498 6.25843 numMergedOcc 0
8 mol 25 unq 3 iso 0 dist 8.94828 15.6642 7.17969 12.0615 6.08585 7.55264 19.4958 13.8469 10.4337 8.88938 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 9.9795 9.53239 7.97049 5.20528 9.29301 9.82915 12.9555 14.4725 10.4987 9.66222 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 9.83528 12.3158 5.08437 11.7625 7.06961 6.7117 13.1846 11.3043 7.94178 7.36769 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 9.83528 12.3158 5.08437 11.7625 7.06961 6.7117 15.5475 6.65501 4.4057 6.88901 numMergedOcc 0
12 mol 98 unq 2 iso 0 dist 9.83528 8.06684 6.10456 11.7625 7.06961 4.47349 13.1846 11.3043 9.85543 7.36769 numMergedOcc 0
13 mol 98 unq 3 iso 0 dist 9.83528 8.06684 6.10456 11.7625 7.06961 4.47349 15.5475 6.65501 9.67482 6.88901 numMergedOcc 0
14 mol 98 unq 4 iso 0 dist 7.54969 11.7493 5.08437 9.49967 7.06961 6.7117 14.4421 11.3043 7.94178 7.36769 numMergedOcc 0
15 mol 98 unq 5 iso 0 dist 7.54969 11.7493 5.08437 9.49967 7.06961 6.7117 13.2316 6.65501 4.4057 6.88901 numMergedOcc 0
16 mol 98 unq 6 iso 0 dist 7.54969 5.15322 6.10456 9.49967 7.06961 4.47349 14.4421 11.3043 9.85543 7.36769 numMergedOcc 0
17 mol 98 unq 7 iso 0 dist 7.54969 5.15322 6.10456 9.49967 7.06961 4.47349 13.2316 6.65501 9.67482 6.88901 numMergedOcc 0
18 mol 102 unq 0 iso 0 dist 8.84131 8.90571 7.36792 14.9418 7.42011 8.31932 11.7136 9.24642 4.48396 8.88394 numMergedOcc 0
19 mol 113 unq 0 iso 0 dist 9.70016 13.2553 5.86073 17.7779 10.1816 8.8822 18.7042 11.9334 7.27193 6.6317 numMergedOcc 0
20 mol 133 unq 0 iso 0 dist 9.00172 13.2145 6.29155 12.0146 4.54648 6.16242 11.4632 10.9581 12.131 8.95662 numMergedOcc 0
21 mol 133 unq 1 iso 0 dist 9.00172 15.719 6.80239 12.0146 4.54648 5.87634 11.4632 10.9581 14.8102 8.95662 numMergedOcc 0
22 mol 134 unq 0 iso 0 dist 4.68975 9.30817 9.89303 7.85849 4.60632 7.69991 6.64576 5.83771 7.41674 6.40575 numMergedOcc 0
23 mol 134 unq 1 iso 0 dist 8.84656 10.879 6.37586 7.85849 5.29786 6.23142 6.64576 10.7586 9.87376 6.40575 numMergedOcc 0
24 mol 134 unq 2 iso 0 dist 8.84656 16.7911 9.71307 7.85849 5.29786 9.94764 6.64576 10.7586 14.9876 6.40575 numMergedOcc 0
25 mol 134 unq 3 iso 0 dist 4.9155 9.30817 6.54501 7.85849 5.71679 7.69991 6.64576 7.80532 7.41674 6.40575 numMergedOcc 0
26 mol 134 unq 4 iso 0 dist 4.9155 10.879 6.49416 7.85849 5.71679 6.23142 6.64576 7.80532 9.87376 6.40575 numMergedOcc 0
27 mol 134 unq 5 iso 0 dist 8.49987 6.47843 6.54501 10.2775 5.71679 7.69991 5.54455 7.80532 7.41674 6.40575 numMergedOcc 0
28 mol 134 unq 6 iso 0 dist 8.49987 10.9399 6.49416 10.2775 5.71679 6.23142 5.54455 7.80532 9.87376 6.40575 numMergedOcc 0
29 mol 134 unq 7 iso 0 dist 9.42271 6.16353 6.54501 6.08299 5.71679 7.69991 5.87436 7.80532 7.41674 6.40575 numMergedOcc 0
30 mol 134 unq 8 iso 0 dist 9.42271 7.07625 6.49416 6.08299 5.71679 6.23142 5.87436 7.80532 9.87376 6.40575 numMergedOcc 0
31 mol 181 unq 0 iso 0 dist 9.74465 8.42326 8.03334 12.3404 7.81713 6.2479 5.03999 6.46704 4.43096 7.32087 numMergedOcc 0
32 mol 181 unq 1 iso 0 dist 9.74465 8.42326 8.03334 12.3404 7.81713 6.2479 13.5125 6.59025 8.04639 8.86197 numMergedOcc 0
33 mol 181 unq 2 iso 0 dist 8.27794 4.89429 9.09537 13.9347 12.9468 9.72611 15.4211 14.8662 12.7358 7.22883 numMergedOcc 0
34 mol 181 unq 3 iso 0 dist 8.27794 4.89429 9.09537 10.4668 10.09 7.99195 13.9331 16.4314 12.2164 7.32087 numMergedOcc 0
35 mol 181 unq 4 iso 0 dist 8.27794 4.89429 9.09537 10.4668 10.09 7.99195 4.80772 11.3325 5.77299 8.86197 numMergedOcc 0
36 mol 232 unq 0 iso 0 dist 7.57253 9.29407 8.27212 11.059 4.9377 9.40808 19.1161 13.7227 12.5452 9.78181 numMergedOcc 0
37 mol 232 unq 1 iso 0 dist 7.57253 9.29407 8.27212 11.059 4.9377 9.40808 5.70548 9.05071 8.80479 9.8664 numMergedOcc 0
38 mol 249 unq 0 iso 0 dist 7.79723 4.24754 7.57994 9.49843 10.7772 5.48118 12.0831 16.0282 9.0676 5.9627 numMergedOcc 0
39 mol 249 unq 1 iso 0 dist 8.14526 4.24754 6.18582 9.49843 7.04666 5.48118 12.0831 12.4721 9.0676 5.9627 numMergedOcc 0
40 mol 274 unq 0 iso 0 dist 9.13226 10.7073 7.56915 6.74022 5.29529 8.52587 8.85159 9.85289 6.20558 6.88827 numMergedOcc 0
41 mol 274 unq 1 iso 0 dist 9.13226 10.7073 7.56915 6.74022 5.29529 8.52587 9.16187 14.1515 16.3619 9.16942 numMergedOcc 0
